today’s outline - october 03, 2016csrri.iit.edu/~segre/phys570/16f/lecture_12.pdftoday’s outline...
TRANSCRIPT
![Page 1: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/1.jpg)
Today’s Outline - October 03, 2016
• Scattering from two electrons
• Scattering from atoms
• Scattering from molecules
• Radial distribution function
• Liquid scattering
APS Visits:10-ID: Friday, October 21, 201610-BM: Friday, October 28, 2016
Homework Assignment #03:Chapter 3: 1, 3, 4, 6, 8due Wednesday, September 05, 2016
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 1 / 17
![Page 2: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/2.jpg)
Today’s Outline - October 03, 2016
• Scattering from two electrons
• Scattering from atoms
• Scattering from molecules
• Radial distribution function
• Liquid scattering
APS Visits:10-ID: Friday, October 21, 201610-BM: Friday, October 28, 2016
Homework Assignment #03:Chapter 3: 1, 3, 4, 6, 8due Wednesday, September 05, 2016
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 1 / 17
![Page 3: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/3.jpg)
Today’s Outline - October 03, 2016
• Scattering from two electrons
• Scattering from atoms
• Scattering from molecules
• Radial distribution function
• Liquid scattering
APS Visits:10-ID: Friday, October 21, 201610-BM: Friday, October 28, 2016
Homework Assignment #03:Chapter 3: 1, 3, 4, 6, 8due Wednesday, September 05, 2016
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 1 / 17
![Page 4: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/4.jpg)
Today’s Outline - October 03, 2016
• Scattering from two electrons
• Scattering from atoms
• Scattering from molecules
• Radial distribution function
• Liquid scattering
APS Visits:10-ID: Friday, October 21, 201610-BM: Friday, October 28, 2016
Homework Assignment #03:Chapter 3: 1, 3, 4, 6, 8due Wednesday, September 05, 2016
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 1 / 17
![Page 5: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/5.jpg)
Today’s Outline - October 03, 2016
• Scattering from two electrons
• Scattering from atoms
• Scattering from molecules
• Radial distribution function
• Liquid scattering
APS Visits:10-ID: Friday, October 21, 201610-BM: Friday, October 28, 2016
Homework Assignment #03:Chapter 3: 1, 3, 4, 6, 8due Wednesday, September 05, 2016
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 1 / 17
![Page 6: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/6.jpg)
Today’s Outline - October 03, 2016
• Scattering from two electrons
• Scattering from atoms
• Scattering from molecules
• Radial distribution function
• Liquid scattering
APS Visits:10-ID: Friday, October 21, 201610-BM: Friday, October 28, 2016
Homework Assignment #03:Chapter 3: 1, 3, 4, 6, 8due Wednesday, September 05, 2016
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 1 / 17
![Page 7: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/7.jpg)
Today’s Outline - October 03, 2016
• Scattering from two electrons
• Scattering from atoms
• Scattering from molecules
• Radial distribution function
• Liquid scattering
APS Visits:10-ID: Friday, October 21, 201610-BM: Friday, October 28, 2016
Homework Assignment #03:Chapter 3: 1, 3, 4, 6, 8due Wednesday, September 05, 2016
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 1 / 17
![Page 8: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/8.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 9: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/9.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 10: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/10.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 11: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/11.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 12: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/12.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 13: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/13.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 14: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/14.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 15: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/15.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 16: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/16.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 17: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/17.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)
= 2r20
(1 + cos(~Q ·~r)
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
![Page 18: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/18.jpg)
Scattering from two electrons
Consider systems where there is only weak scattering, with no multiplescattering effects. We begin with the scattering of x-rays from twoelectrons.
r
2θ
k
k
2θ
Q
k
k
~Q = (~k − ~k ′)
|~Q| = 2k sin θ =4π
λsin θ
The scattering from the second electron willhave a phase shift of φ = ~Q ·~r .
A(~Q) = −r0(
1 + e i~Q·~r)
I (~Q) = A(~Q)∗A(~Q)
= r20
(1 + e i
~Q·~r)(
1 + e−i~Q·~r)
I (~Q) = r20
(1 + e i
~Q·~r + e−i~Q·~r + 1
)= 2r20
(1 + cos(~Q ·~r)
)C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 2 / 17
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Scattering from many electrons
for many electrons
generalizing to a crystal
A(~Q) = −r0∑j
e i~Q·~rj
A(~Q) = −r0∑N
e i~Q· ~RN
∑j
e i~Q·~rj
Since experiments measure I ∝ A2, the phase information is lost. This is aproblem if we don’t know the specific orientation of the scattering systemrelative to the x-ray beam.
We will now look at the consequences of this orientation and generalize tomore than two electrons
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 3 / 17
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Scattering from many electrons
for many electrons
generalizing to a crystal
A(~Q) = −r0∑j
e i~Q·~rj
A(~Q) = −r0∑N
e i~Q· ~RN
∑j
e i~Q·~rj
Since experiments measure I ∝ A2, the phase information is lost. This is aproblem if we don’t know the specific orientation of the scattering systemrelative to the x-ray beam.
We will now look at the consequences of this orientation and generalize tomore than two electrons
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 3 / 17
![Page 21: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/21.jpg)
Scattering from many electrons
for many electrons
generalizing to a crystal
A(~Q) = −r0∑j
e i~Q·~rj
A(~Q) = −r0∑N
e i~Q· ~RN
∑j
e i~Q·~rj
Since experiments measure I ∝ A2, the phase information is lost. This is aproblem if we don’t know the specific orientation of the scattering systemrelative to the x-ray beam.
We will now look at the consequences of this orientation and generalize tomore than two electrons
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 3 / 17
![Page 22: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/22.jpg)
Scattering from many electrons
for many electrons
generalizing to a crystal
A(~Q) = −r0∑j
e i~Q·~rj
A(~Q) = −r0∑N
e i~Q· ~RN
∑j
e i~Q·~rj
Since experiments measure I ∝ A2, the phase information is lost. This is aproblem if we don’t know the specific orientation of the scattering systemrelative to the x-ray beam.
We will now look at the consequences of this orientation and generalize tomore than two electrons
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 3 / 17
![Page 23: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/23.jpg)
Scattering from many electrons
for many electrons
generalizing to a crystal
A(~Q) = −r0∑j
e i~Q·~rj
A(~Q) = −r0∑N
e i~Q· ~RN
∑j
e i~Q·~rj
Since experiments measure I ∝ A2, the phase information is lost. This is aproblem if we don’t know the specific orientation of the scattering systemrelative to the x-ray beam.
We will now look at the consequences of this orientation and generalize tomore than two electrons
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 3 / 17
![Page 24: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/24.jpg)
Scattering from many electrons
for many electrons
generalizing to a crystal
A(~Q) = −r0∑j
e i~Q·~rj
A(~Q) = −r0∑N
e i~Q· ~RN
∑j
e i~Q·~rj
Since experiments measure I ∝ A2, the phase information is lost. This is aproblem if we don’t know the specific orientation of the scattering systemrelative to the x-ray beam.
We will now look at the consequences of this orientation and generalize tomore than two electrons
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 3 / 17
![Page 25: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/25.jpg)
Two electrons — fixed orientation
The expression
I (~Q) = 2r20
(1 + cos(~Q ·~r)
)assumes that the two electronshave a specific, fixed orienta-tion. In this case the intensityas a function of Q is.
Fixed orientation is not theusual case, particularly for solu-tion and small-angle scattering. 0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 4 / 17
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Two electrons — fixed orientation
The expression
I (~Q) = 2r20
(1 + cos(~Q ·~r)
)assumes that the two electronshave a specific, fixed orienta-tion. In this case the intensityas a function of Q is.
Fixed orientation is not theusual case, particularly for solu-tion and small-angle scattering.
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 4 / 17
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Two electrons — fixed orientation
The expression
I (~Q) = 2r20
(1 + cos(~Q ·~r)
)assumes that the two electronshave a specific, fixed orienta-tion. In this case the intensityas a function of Q is.
Fixed orientation is not theusual case, particularly for solu-tion and small-angle scattering. 0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r
⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r
⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in space
and we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in space
and we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr
=sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Orientation averaging
A(~Q) = f1 + f2ei ~Q·~r
I (~Q) = f 21 + f 22 + f1f2ei ~Q·~r + f1f2e
−i ~Q·~r⟨I (~Q)
⟩= f 21 + f 22 + 2f1f2
⟨e i~Q·~r⟩
⟨e i~Q·~r⟩
=
∫e iQr cos θ sin θdθdφ∫
sin θdθdφ
=1
4π2π
∫ π
0e iQr cos θ sin θdθ
=2π
4π
(− 1
iQr
)∫ −iQr
iQrexdx
=1
22
sin(Qr)
Qr=
sin(Qr)
Qr
Consider scattering from twoarbitrary electron distribu-tions, f1 and f2. A(~Q), isgiven by
and the intensity, I (~Q), is
if the distance between thescatterers,~r , remains constant(no vibrations) but is allowedto orient randomly in spaceand we take ~Q along the z-axis
substituting x = iQr cos θ anddx = −iQr sin θdθ⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
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Randomly oriented electrons
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
Recall that when we had a fixedorientation of the two electrons,we had and intensity variationI (~Q) = 2r20 (1 + cos(Qr)).
When we now replace the twoarbitrary scattering distributionswith electrons (f1, f2 → −r0),we change the intensity profilesignificantly.⟨I (~Q)
⟩= 2r20
(1 +
sin(Qr)
Qr
)0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
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Randomly oriented electrons
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
Recall that when we had a fixedorientation of the two electrons,we had and intensity variationI (~Q) = 2r20 (1 + cos(Qr)).
When we now replace the twoarbitrary scattering distributionswith electrons (f1, f2 → −r0),we change the intensity profilesignificantly.⟨I (~Q)
⟩= 2r20
(1 +
sin(Qr)
Qr
)0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
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Randomly oriented electrons
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
Recall that when we had a fixedorientation of the two electrons,we had and intensity variationI (~Q) = 2r20 (1 + cos(Qr)).
When we now replace the twoarbitrary scattering distributionswith electrons (f1, f2 → −r0),we change the intensity profilesignificantly.⟨I (~Q)
⟩= 2r20
(1 +
sin(Qr)
Qr
)
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 6 / 17
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Randomly oriented electrons
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
Recall that when we had a fixedorientation of the two electrons,we had and intensity variationI (~Q) = 2r20 (1 + cos(Qr)).
When we now replace the twoarbitrary scattering distributionswith electrons (f1, f2 → −r0),we change the intensity profilesignificantly.
⟨I (~Q)
⟩= 2r20
(1 +
sin(Qr)
Qr
)
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 6 / 17
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Randomly oriented electrons
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
Recall that when we had a fixedorientation of the two electrons,we had and intensity variationI (~Q) = 2r20 (1 + cos(Qr)).
When we now replace the twoarbitrary scattering distributionswith electrons (f1, f2 → −r0),we change the intensity profilesignificantly.⟨I (~Q)
⟩= 2r20
(1 +
sin(Qr)
Qr
)0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 6 / 17
![Page 47: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/47.jpg)
Randomly oriented electrons
⟨I (~Q)
⟩= f 21 +f 22 +2f1f2
sin(Qr)
Qr
Recall that when we had a fixedorientation of the two electrons,we had and intensity variationI (~Q) = 2r20 (1 + cos(Qr)).
When we now replace the twoarbitrary scattering distributionswith electrons (f1, f2 → −r0),we change the intensity profilesignificantly.⟨I (~Q)
⟩= 2r20
(1 +
sin(Qr)
Qr
)0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 6 / 17
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Scattering from atoms
Single electrons are a good first example but a real system involvesscattering from atoms. We can use what we have already used to write anexpression for the scattering from an atom, ignoring the anomalous terms.
with limits in units of r0 of
The second limit can be understoodclassically as loss of phase coher-ence when Q is very large and asmall difference in position resultsin an arbitrary change in phase.
ψ1s(r) =1√πa3
e−r/a, a =a0
Z − zs
where zs is a screening correction
f 0(~Q) =
∫ρ(~r)e i
~Q·~rd~r
=
Z for Q→ 0
0 for Q→∞
However, it is better to usequantum mechanics to calculatethe form factor, starting with ahydrogen-like atom as an example.The wave function of the 1s elec-trons is just
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 7 / 17
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Scattering from atoms
Single electrons are a good first example but a real system involvesscattering from atoms. We can use what we have already used to write anexpression for the scattering from an atom, ignoring the anomalous terms.
with limits in units of r0 of
The second limit can be understoodclassically as loss of phase coher-ence when Q is very large and asmall difference in position resultsin an arbitrary change in phase.
ψ1s(r) =1√πa3
e−r/a, a =a0
Z − zs
where zs is a screening correction
f 0(~Q) =
∫ρ(~r)e i
~Q·~rd~r
=
Z for Q→ 0
0 for Q→∞
However, it is better to usequantum mechanics to calculatethe form factor, starting with ahydrogen-like atom as an example.The wave function of the 1s elec-trons is just
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 7 / 17
![Page 50: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/50.jpg)
Scattering from atoms
Single electrons are a good first example but a real system involvesscattering from atoms. We can use what we have already used to write anexpression for the scattering from an atom, ignoring the anomalous terms.
with limits in units of r0 of
The second limit can be understoodclassically as loss of phase coher-ence when Q is very large and asmall difference in position resultsin an arbitrary change in phase.
ψ1s(r) =1√πa3
e−r/a, a =a0
Z − zs
where zs is a screening correction
f 0(~Q) =
∫ρ(~r)e i
~Q·~rd~r
=
Z for Q→ 0
0 for Q→∞
However, it is better to usequantum mechanics to calculatethe form factor, starting with ahydrogen-like atom as an example.The wave function of the 1s elec-trons is just
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 7 / 17
![Page 51: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/51.jpg)
Scattering from atoms
Single electrons are a good first example but a real system involvesscattering from atoms. We can use what we have already used to write anexpression for the scattering from an atom, ignoring the anomalous terms.
with limits in units of r0 of
The second limit can be understoodclassically as loss of phase coher-ence when Q is very large and asmall difference in position resultsin an arbitrary change in phase.
ψ1s(r) =1√πa3
e−r/a, a =a0
Z − zs
where zs is a screening correction
f 0(~Q) =
∫ρ(~r)e i
~Q·~rd~r
=
Z for Q→ 0
0 for Q→∞
However, it is better to usequantum mechanics to calculatethe form factor, starting with ahydrogen-like atom as an example.The wave function of the 1s elec-trons is just
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 7 / 17
![Page 52: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/52.jpg)
Scattering from atoms
Single electrons are a good first example but a real system involvesscattering from atoms. We can use what we have already used to write anexpression for the scattering from an atom, ignoring the anomalous terms.
with limits in units of r0 of
The second limit can be understoodclassically as loss of phase coher-ence when Q is very large and asmall difference in position resultsin an arbitrary change in phase.
ψ1s(r) =1√πa3
e−r/a, a =a0
Z − zs
where zs is a screening correction
f 0(~Q) =
∫ρ(~r)e i
~Q·~rd~r
=
Z for Q→ 0
0 for Q→∞
However, it is better to usequantum mechanics to calculatethe form factor, starting with ahydrogen-like atom as an example.The wave function of the 1s elec-trons is just
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 7 / 17
![Page 53: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/53.jpg)
Scattering from atoms
Single electrons are a good first example but a real system involvesscattering from atoms. We can use what we have already used to write anexpression for the scattering from an atom, ignoring the anomalous terms.
with limits in units of r0 of
The second limit can be understoodclassically as loss of phase coher-ence when Q is very large and asmall difference in position resultsin an arbitrary change in phase.
ψ1s(r) =1√πa3
e−r/a, a =a0
Z − zs
where zs is a screening correction
f 0(~Q) =
∫ρ(~r)e i
~Q·~rd~r
=
Z for Q→ 0
0 for Q→∞
However, it is better to usequantum mechanics to calculatethe form factor, starting with ahydrogen-like atom as an example.The wave function of the 1s elec-trons is just
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 7 / 17
![Page 54: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/54.jpg)
Scattering from atoms
Single electrons are a good first example but a real system involvesscattering from atoms. We can use what we have already used to write anexpression for the scattering from an atom, ignoring the anomalous terms.
with limits in units of r0 of
The second limit can be understoodclassically as loss of phase coher-ence when Q is very large and asmall difference in position resultsin an arbitrary change in phase.
ψ1s(r) =1√πa3
e−r/a, a =a0
Z − zs
where zs is a screening correction
f 0(~Q) =
∫ρ(~r)e i
~Q·~rd~r
=
Z for Q→ 0
0 for Q→∞
However, it is better to usequantum mechanics to calculatethe form factor, starting with ahydrogen-like atom as an example.The wave function of the 1s elec-trons is just
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 7 / 17
![Page 55: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/55.jpg)
Scattering from atoms
Single electrons are a good first example but a real system involvesscattering from atoms. We can use what we have already used to write anexpression for the scattering from an atom, ignoring the anomalous terms.
with limits in units of r0 of
The second limit can be understoodclassically as loss of phase coher-ence when Q is very large and asmall difference in position resultsin an arbitrary change in phase.
ψ1s(r) =1√πa3
e−r/a, a =a0
Z − zs
where zs is a screening correction
f 0(~Q) =
∫ρ(~r)e i
~Q·~rd~r
=
Z for Q→ 0
0 for Q→∞
However, it is better to usequantum mechanics to calculatethe form factor, starting with ahydrogen-like atom as an example.The wave function of the 1s elec-trons is just
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 7 / 17
![Page 56: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/56.jpg)
Hydrogen form factor calculation
Since ρ(r) = |ψ1s(r)|2, the form factor integral becomes
f 01s(~Q) =1
πa3
∫e−2r/ae i
~Q·~r r2 sin θdrdθdφ
the integral in φ gives 2π and if we choose ~Q to be along the z direction,~Q ·~r → Qr cos θ, so
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a∫ π
0e iQr cos θ sin θdθdr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[−e iQr cos θ
∣∣∣π0dr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[e iQr − e−iQr
]dr
=1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 8 / 17
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Hydrogen form factor calculation
Since ρ(r) = |ψ1s(r)|2, the form factor integral becomes
f 01s(~Q) =1
πa3
∫e−2r/ae i
~Q·~r r2 sin θdrdθdφ
the integral in φ gives 2π and if we choose ~Q to be along the z direction,~Q ·~r → Qr cos θ, so
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a∫ π
0e iQr cos θ sin θdθdr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[−e iQr cos θ
∣∣∣π0dr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[e iQr − e−iQr
]dr
=1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 8 / 17
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Hydrogen form factor calculation
Since ρ(r) = |ψ1s(r)|2, the form factor integral becomes
f 01s(~Q) =1
πa3
∫e−2r/ae i
~Q·~r r2 sin θdrdθdφ
the integral in φ gives 2π and if we choose ~Q to be along the z direction,~Q ·~r → Qr cos θ, so
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a∫ π
0e iQr cos θ sin θdθdr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[−e iQr cos θ
∣∣∣π0dr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[e iQr − e−iQr
]dr
=1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 8 / 17
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Hydrogen form factor calculation
Since ρ(r) = |ψ1s(r)|2, the form factor integral becomes
f 01s(~Q) =1
πa3
∫e−2r/ae i
~Q·~r r2 sin θdrdθdφ
the integral in φ gives 2π and if we choose ~Q to be along the z direction,~Q ·~r → Qr cos θ, so
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a∫ π
0e iQr cos θ sin θdθdr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[−e iQr cos θ
∣∣∣π0dr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[e iQr − e−iQr
]dr
=1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 8 / 17
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Hydrogen form factor calculation
Since ρ(r) = |ψ1s(r)|2, the form factor integral becomes
f 01s(~Q) =1
πa3
∫e−2r/ae i
~Q·~r r2 sin θdrdθdφ
the integral in φ gives 2π and if we choose ~Q to be along the z direction,~Q ·~r → Qr cos θ, so
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a∫ π
0e iQr cos θ sin θdθdr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[−e iQr cos θ
∣∣∣π0dr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[e iQr − e−iQr
]dr
=1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 8 / 17
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Hydrogen form factor calculation
Since ρ(r) = |ψ1s(r)|2, the form factor integral becomes
f 01s(~Q) =1
πa3
∫e−2r/ae i
~Q·~r r2 sin θdrdθdφ
the integral in φ gives 2π and if we choose ~Q to be along the z direction,~Q ·~r → Qr cos θ, so
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a∫ π
0e iQr cos θ sin θdθdr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[−e iQr cos θ
∣∣∣π0dr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[e iQr − e−iQr
]dr
=1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 8 / 17
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Hydrogen form factor calculation
Since ρ(r) = |ψ1s(r)|2, the form factor integral becomes
f 01s(~Q) =1
πa3
∫e−2r/ae i
~Q·~r r2 sin θdrdθdφ
the integral in φ gives 2π and if we choose ~Q to be along the z direction,~Q ·~r → Qr cos θ, so
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a∫ π
0e iQr cos θ sin θdθdr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[−e iQr cos θ
∣∣∣π0dr
=1
πa3
∫ ∞0
2πr2e−2r/a1
iQr
[e iQr − e−iQr
]dr
=1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 8 / 17
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Form factor calculation
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
If we write sin(Qr) = Im[e iQr
]then the integral becomes
f 01s(~Q) =4
a3Q
∫ ∞0
re−2r/aIm[e iQr
]dr
=4
a3QIm
[∫ ∞0
re−2r/ae iQrdr
]
this can be integrated by parts with
u = r dv = e−r(2/a−iQ)dr
du = dr v = −e−r(2/a−iQ)
(2/a− iQ)
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 9 / 17
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Form factor calculation
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
If we write sin(Qr) = Im[e iQr
]then the integral becomes
f 01s(~Q) =4
a3Q
∫ ∞0
re−2r/aIm[e iQr
]dr
=4
a3QIm
[∫ ∞0
re−2r/ae iQrdr
]
this can be integrated by parts with
u = r dv = e−r(2/a−iQ)dr
du = dr v = −e−r(2/a−iQ)
(2/a− iQ)
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 9 / 17
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Form factor calculation
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
If we write sin(Qr) = Im[e iQr
]then the integral becomes
f 01s(~Q) =4
a3Q
∫ ∞0
re−2r/aIm[e iQr
]dr
=4
a3QIm
[∫ ∞0
re−2r/ae iQrdr
]this can be integrated by parts with
u = r dv = e−r(2/a−iQ)dr
du = dr v = −e−r(2/a−iQ)
(2/a− iQ)
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 9 / 17
![Page 66: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/66.jpg)
Form factor calculation
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
If we write sin(Qr) = Im[e iQr
]then the integral becomes
f 01s(~Q) =4
a3Q
∫ ∞0
re−2r/aIm[e iQr
]dr =
4
a3QIm
[∫ ∞0
re−2r/ae iQrdr
]
this can be integrated by parts with
u = r dv = e−r(2/a−iQ)dr
du = dr v = −e−r(2/a−iQ)
(2/a− iQ)
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 9 / 17
![Page 67: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/67.jpg)
Form factor calculation
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
If we write sin(Qr) = Im[e iQr
]then the integral becomes
f 01s(~Q) =4
a3Q
∫ ∞0
re−2r/aIm[e iQr
]dr =
4
a3QIm
[∫ ∞0
re−2r/ae iQrdr
]this can be integrated by parts with
u = r dv = e−r(2/a−iQ)dr
du = dr v = −e−r(2/a−iQ)
(2/a− iQ)
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 9 / 17
![Page 68: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/68.jpg)
Form factor calculation
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
If we write sin(Qr) = Im[e iQr
]then the integral becomes
f 01s(~Q) =4
a3Q
∫ ∞0
re−2r/aIm[e iQr
]dr =
4
a3QIm
[∫ ∞0
re−2r/ae iQrdr
]this can be integrated by parts with
u = r dv = e−r(2/a−iQ)dr
du = dr v = −e−r(2/a−iQ)
(2/a− iQ)
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 9 / 17
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Form factor calculation
f 01s(~Q) =1
πa3
∫ ∞0
2πr2e−2r/a2 sin(Qr)
Qrdr
If we write sin(Qr) = Im[e iQr
]then the integral becomes
f 01s(~Q) =4
a3Q
∫ ∞0
re−2r/aIm[e iQr
]dr =
4
a3QIm
[∫ ∞0
re−2r/ae iQrdr
]this can be integrated by parts with
u = r dv = e−r(2/a−iQ)dr
du = dr v = −e−r(2/a−iQ)
(2/a− iQ)
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 9 / 17
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Form factor calculation
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]
the first term becomes zero because re−r(2/a−iQ) → 0 as r → 0, thesecond is easily integrated
f 01s(~Q) =4
a3QIm
[− e−r(2/a−iQ)
(2/a− iQ)2
∣∣∣∣∣∞
0
]=
4
a3QIm
[1
(2/a− iQ)2
]=
4
a3QIm
[(2/a + iQ)2
(2/a− iQ)2(2/a + iQ)2
]=
4
a3QIm
[(2/a)2 + i(4Q/a)− Q2
[(2/a)2 + Q2]2
]
f 01s(~Q)
=4
a3Q
(a/2)4(4Q/a)
[1 + (Qa/2)2]2=
1
[1 + (Qa/2)2]2
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 10 / 17
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Form factor calculation
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]the first term becomes zero because re−r(2/a−iQ) → 0 as r → 0, thesecond is easily integrated
f 01s(~Q) =4
a3QIm
[− e−r(2/a−iQ)
(2/a− iQ)2
∣∣∣∣∣∞
0
]=
4
a3QIm
[1
(2/a− iQ)2
]=
4
a3QIm
[(2/a + iQ)2
(2/a− iQ)2(2/a + iQ)2
]=
4
a3QIm
[(2/a)2 + i(4Q/a)− Q2
[(2/a)2 + Q2]2
]
f 01s(~Q)
=4
a3Q
(a/2)4(4Q/a)
[1 + (Qa/2)2]2=
1
[1 + (Qa/2)2]2
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 10 / 17
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Form factor calculation
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]the first term becomes zero because re−r(2/a−iQ) → 0 as r → 0, thesecond is easily integrated
f 01s(~Q) =4
a3QIm
[− e−r(2/a−iQ)
(2/a− iQ)2
∣∣∣∣∣∞
0
]
=4
a3QIm
[1
(2/a− iQ)2
]=
4
a3QIm
[(2/a + iQ)2
(2/a− iQ)2(2/a + iQ)2
]=
4
a3QIm
[(2/a)2 + i(4Q/a)− Q2
[(2/a)2 + Q2]2
]
f 01s(~Q)
=4
a3Q
(a/2)4(4Q/a)
[1 + (Qa/2)2]2=
1
[1 + (Qa/2)2]2
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 10 / 17
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Form factor calculation
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]the first term becomes zero because re−r(2/a−iQ) → 0 as r → 0, thesecond is easily integrated
f 01s(~Q) =4
a3QIm
[− e−r(2/a−iQ)
(2/a− iQ)2
∣∣∣∣∣∞
0
]=
4
a3QIm
[1
(2/a− iQ)2
]
=4
a3QIm
[(2/a + iQ)2
(2/a− iQ)2(2/a + iQ)2
]=
4
a3QIm
[(2/a)2 + i(4Q/a)− Q2
[(2/a)2 + Q2]2
]
f 01s(~Q)
=4
a3Q
(a/2)4(4Q/a)
[1 + (Qa/2)2]2=
1
[1 + (Qa/2)2]2
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 10 / 17
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Form factor calculation
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]the first term becomes zero because re−r(2/a−iQ) → 0 as r → 0, thesecond is easily integrated
f 01s(~Q) =4
a3QIm
[− e−r(2/a−iQ)
(2/a− iQ)2
∣∣∣∣∣∞
0
]=
4
a3QIm
[1
(2/a− iQ)2
]=
4
a3QIm
[(2/a + iQ)2
(2/a− iQ)2(2/a + iQ)2
]
=4
a3QIm
[(2/a)2 + i(4Q/a)− Q2
[(2/a)2 + Q2]2
]
f 01s(~Q)
=4
a3Q
(a/2)4(4Q/a)
[1 + (Qa/2)2]2=
1
[1 + (Qa/2)2]2
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 10 / 17
![Page 75: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/75.jpg)
Form factor calculation
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]the first term becomes zero because re−r(2/a−iQ) → 0 as r → 0, thesecond is easily integrated
f 01s(~Q) =4
a3QIm
[− e−r(2/a−iQ)
(2/a− iQ)2
∣∣∣∣∣∞
0
]=
4
a3QIm
[1
(2/a− iQ)2
]=
4
a3QIm
[(2/a + iQ)2
(2/a− iQ)2(2/a + iQ)2
]=
4
a3QIm
[(2/a)2 + i(4Q/a)− Q2
[(2/a)2 + Q2]2
]
f 01s(~Q)
=4
a3Q
(a/2)4(4Q/a)
[1 + (Qa/2)2]2=
1
[1 + (Qa/2)2]2
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 10 / 17
![Page 76: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/76.jpg)
Form factor calculation
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]the first term becomes zero because re−r(2/a−iQ) → 0 as r → 0, thesecond is easily integrated
f 01s(~Q) =4
a3QIm
[− e−r(2/a−iQ)
(2/a− iQ)2
∣∣∣∣∣∞
0
]=
4
a3QIm
[1
(2/a− iQ)2
]=
4
a3QIm
[(2/a + iQ)2
(2/a− iQ)2(2/a + iQ)2
]=
4
a3QIm
[(2/a)2 + i(4Q/a)− Q2
[(2/a)2 + Q2]2
]
f 01s(~Q)
=4
a3Q
(a/2)4(4Q/a)
[1 + (Qa/2)2]2
=1
[1 + (Qa/2)2]2
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 10 / 17
![Page 77: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/77.jpg)
Form factor calculation
f 01s(~Q) =4
a3QIm
[re−r(2/a−iQ)
(2/a− iQ)
∣∣∣∣∣∞
0
+
∫ ∞0
e−r(2/a−iQ)
(2/a− iQ)dr
]the first term becomes zero because re−r(2/a−iQ) → 0 as r → 0, thesecond is easily integrated
f 01s(~Q) =4
a3QIm
[− e−r(2/a−iQ)
(2/a− iQ)2
∣∣∣∣∣∞
0
]=
4
a3QIm
[1
(2/a− iQ)2
]=
4
a3QIm
[(2/a + iQ)2
(2/a− iQ)2(2/a + iQ)2
]=
4
a3QIm
[(2/a)2 + i(4Q/a)− Q2
[(2/a)2 + Q2]2
]f 01s(~Q) =
4
a3Q
(a/2)4(4Q/a)
[1 + (Qa/2)2]2=
1
[1 + (Qa/2)2]2
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 10 / 17
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1s and atomic form factors
f 01s(~Q) =1
[1 + (Qa/2)2]2
This partial form factor will varywith Z due to the Coulomb inter-action
In principle, one can compute thefull atomic form factors, however,it is more useful to tabulate the ex-perimentally measured form factors
0 5
Qao
0
5
10
f0(Q
)
C
O
F
f 0 (Q) =4∑
j=1
aje−bj sin2 θ/λ2 + c =
4∑j=1
aje−bj (Q/4π)2 + c
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 11 / 17
![Page 79: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/79.jpg)
1s and atomic form factors
f 01s(~Q) =1
[1 + (Qa/2)2]2
This partial form factor will varywith Z due to the Coulomb inter-action
In principle, one can compute thefull atomic form factors, however,it is more useful to tabulate the ex-perimentally measured form factors
0 5
Qao
0
5
10
f0(Q
)
C
O
F
f 0 (Q) =4∑
j=1
aje−bj sin2 θ/λ2 + c =
4∑j=1
aje−bj (Q/4π)2 + c
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 11 / 17
![Page 80: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/80.jpg)
1s and atomic form factors
f 01s(~Q) =1
[1 + (Qa/2)2]2
This partial form factor will varywith Z due to the Coulomb inter-action
In principle, one can compute thefull atomic form factors, however,it is more useful to tabulate the ex-perimentally measured form factors
0 1 2 3 4 5
Qao
0.0
0.5
1.0
f0 1s(Q
)
Z=1
Z=3
Z=5
f 0 (Q) =4∑
j=1
aje−bj sin2 θ/λ2 + c =
4∑j=1
aje−bj (Q/4π)2 + c
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 11 / 17
![Page 81: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/81.jpg)
1s and atomic form factors
f 01s(~Q) =1
[1 + (Qa/2)2]2
This partial form factor will varywith Z due to the Coulomb inter-action
In principle, one can compute thefull atomic form factors, however,it is more useful to tabulate the ex-perimentally measured form factors 0 1 2 3 4 5
Qao
0.0
0.5
1.0
f0 1s(Q
)
Z=1
Z=3
Z=5
f 0 (Q) =4∑
j=1
aje−bj sin2 θ/λ2 + c =
4∑j=1
aje−bj (Q/4π)2 + c
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 11 / 17
![Page 82: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/82.jpg)
1s and atomic form factors
f 01s(~Q) =1
[1 + (Qa/2)2]2
This partial form factor will varywith Z due to the Coulomb inter-action
In principle, one can compute thefull atomic form factors, however,it is more useful to tabulate the ex-perimentally measured form factors 0 1 2 3 4 5
Qao
0.0
0.5
1.0
f0 1s(Q
)
Z=1
Z=3
Z=5
f 0 (Q) =4∑
j=1
aje−bj sin2 θ/λ2 + c
=4∑
j=1
aje−bj (Q/4π)2 + c
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 11 / 17
![Page 83: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/83.jpg)
1s and atomic form factors
f 01s(~Q) =1
[1 + (Qa/2)2]2
This partial form factor will varywith Z due to the Coulomb inter-action
In principle, one can compute thefull atomic form factors, however,it is more useful to tabulate the ex-perimentally measured form factors 0 1 2 3 4 5
Qao
0.0
0.5
1.0
f0 1s(Q
)
Z=1
Z=3
Z=5
f 0 (Q) =4∑
j=1
aje−bj sin2 θ/λ2 + c =
4∑j=1
aje−bj (Q/4π)2 + c
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 11 / 17
![Page 84: Today’s Outline - October 03, 2016csrri.iit.edu/~segre/phys570/16F/lecture_12.pdfToday’s Outline - October 03, 2016 Scattering from two electrons Scattering from atoms Scattering](https://reader033.vdocuments.us/reader033/viewer/2022043012/5fabdb5e2d092f4995742237/html5/thumbnails/84.jpg)
1s and atomic form factors
f 01s(~Q) =1
[1 + (Qa/2)2]2
This partial form factor will varywith Z due to the Coulomb inter-action
In principle, one can compute thefull atomic form factors, however,it is more useful to tabulate the ex-perimentally measured form factors
0 5
Qao
0
5
10
f0(Q
)
C
O
F
f 0 (Q) =4∑
j=1
aje−bj sin2 θ/λ2 + c =
4∑j=1
aje−bj (Q/4π)2 + c
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 11 / 17
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Two hydrogen atoms
Previously we derived the scat-tering intensity from two local-ized electrons both fixed andrandomly oriented to the x-rays
when we now replace the two lo-calized electrons with hydrogenatoms, we have, for fixed atoms
and if we allow the hydrogenatoms to be randomly orientedwe have
with no oscillating structure inthe form factor
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 12 / 17
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Two hydrogen atoms
Previously we derived the scat-tering intensity from two local-ized electrons both fixed andrandomly oriented to the x-rays
when we now replace the two lo-calized electrons with hydrogenatoms, we have, for fixed atoms
and if we allow the hydrogenatoms to be randomly orientedwe have
with no oscillating structure inthe form factor
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 12 / 17
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Two hydrogen atoms
Previously we derived the scat-tering intensity from two local-ized electrons both fixed andrandomly oriented to the x-rays
when we now replace the two lo-calized electrons with hydrogenatoms, we have, for fixed atoms
and if we allow the hydrogenatoms to be randomly orientedwe have
with no oscillating structure inthe form factor
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 12 / 17
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Two hydrogen atoms
Previously we derived the scat-tering intensity from two local-ized electrons both fixed andrandomly oriented to the x-rays
when we now replace the two lo-calized electrons with hydrogenatoms, we have, for fixed atoms
and if we allow the hydrogenatoms to be randomly orientedwe have
with no oscillating structure inthe form factor
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 12 / 17
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Two hydrogen atoms
Previously we derived the scat-tering intensity from two local-ized electrons both fixed andrandomly oriented to the x-rays
when we now replace the two lo-calized electrons with hydrogenatoms, we have, for fixed atoms
and if we allow the hydrogenatoms to be randomly orientedwe have
with no oscillating structure inthe form factor
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 12 / 17
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Two hydrogen atoms
Previously we derived the scat-tering intensity from two local-ized electrons both fixed andrandomly oriented to the x-rays
when we now replace the two lo-calized electrons with hydrogenatoms, we have, for fixed atoms
and if we allow the hydrogenatoms to be randomly orientedwe have
with no oscillating structure inthe form factor
0 0.5 1 1.5 2
Q (units of 2π/r)
0
1
2
3
4
Inte
nsity (
units o
f r2 o
)
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 12 / 17
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Inelastic scattering
The form factors for all atoms dropto zero as Q →∞, however, otherprocesses continue to scatter pho-tons.
In particular, Compton scatteringbecomes dominant.
Compton scattering is an inelasticprocess: |~k| 6= |~k ′| and it is alsoincoherent.
The Compton scattering containsinformation about the momentumdistribution of the electrons in theground state of the atom.
0 5 10
Qao
0
10
20
30
40
f0(Q
)C
Ge
Mo
Cu
Si
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 13 / 17
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Inelastic scattering
The form factors for all atoms dropto zero as Q →∞, however, otherprocesses continue to scatter pho-tons.
In particular, Compton scatteringbecomes dominant.
Compton scattering is an inelasticprocess: |~k| 6= |~k ′| and it is alsoincoherent.
The Compton scattering containsinformation about the momentumdistribution of the electrons in theground state of the atom.
0 5 10
Qao
0
10
20
30
40
f0(Q
)C
Ge
Mo
Cu
Si
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 13 / 17
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Inelastic scattering
The form factors for all atoms dropto zero as Q →∞, however, otherprocesses continue to scatter pho-tons.
In particular, Compton scatteringbecomes dominant.
Compton scattering is an inelasticprocess: |~k| 6= |~k ′|
and it is alsoincoherent.
The Compton scattering containsinformation about the momentumdistribution of the electrons in theground state of the atom.
0 5 10
Qao
0
10
20
30
40
f0(Q
)C
Ge
Mo
Cu
Si
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 13 / 17
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Inelastic scattering
The form factors for all atoms dropto zero as Q →∞, however, otherprocesses continue to scatter pho-tons.
In particular, Compton scatteringbecomes dominant.
Compton scattering is an inelasticprocess: |~k| 6= |~k ′| and it is alsoincoherent.
The Compton scattering containsinformation about the momentumdistribution of the electrons in theground state of the atom.
0 5 10
Qao
0
10
20
30
40
f0(Q
)C
Ge
Mo
Cu
Si
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 13 / 17
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Inelastic scattering
The form factors for all atoms dropto zero as Q →∞, however, otherprocesses continue to scatter pho-tons.
In particular, Compton scatteringbecomes dominant.
Compton scattering is an inelasticprocess: |~k| 6= |~k ′| and it is alsoincoherent.
The Compton scattering containsinformation about the momentumdistribution of the electrons in theground state of the atom.
0 5 10
Qao
0
10
20
30
40
f0(Q
)C
Ge
Mo
Cu
Si
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 13 / 17
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Inelastic scattering
The form factors for all atoms dropto zero as Q →∞, however, otherprocesses continue to scatter pho-tons.
In particular, Compton scatteringbecomes dominant.
Compton scattering is an inelasticprocess: |~k| 6= |~k ′| and it is alsoincoherent.
The Compton scattering containsinformation about the momentumdistribution of the electrons in theground state of the atom.
10500 11000 11500 12000 12500Energy (eV)
X-r
ay Inte
nsity (
arb
units) φ=160
o
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 13 / 17
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Total atomic scattering
We can now write the total scatter-ing from an atom as the sum of twocomponents:
(dσ
dΩ
)el
∼ r20 |f (Q)|2(dσ
dΩ
)in
∼ r20S(Z ,Q)
recall that f (Q)→ Z as Q → 0
so |f (Q)|2 → Z 2 as Q → 0
and for incoherent scattering we ex-pect S(Z ,Q)→ Z as Q →∞
ZHe = 2 ZAr = 18 0 5 10 15 20
Q [Å-1
]
1
10
100
Inte
nsity
(in
uni
ts o
f r02 )
Ar
He
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 14 / 17
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Total atomic scattering
We can now write the total scatter-ing from an atom as the sum of twocomponents:(
dσ
dΩ
)el
∼ r20 |f (Q)|2
(dσ
dΩ
)in
∼ r20S(Z ,Q)
recall that f (Q)→ Z as Q → 0
so |f (Q)|2 → Z 2 as Q → 0
and for incoherent scattering we ex-pect S(Z ,Q)→ Z as Q →∞
ZHe = 2 ZAr = 18 0 5 10 15 20
Q [Å-1
]
1
10
100
Inte
nsity
(in
uni
ts o
f r02 )
Ar
He
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 14 / 17
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Total atomic scattering
We can now write the total scatter-ing from an atom as the sum of twocomponents:(
dσ
dΩ
)el
∼ r20 |f (Q)|2(dσ
dΩ
)in
∼ r20S(Z ,Q)
recall that f (Q)→ Z as Q → 0
so |f (Q)|2 → Z 2 as Q → 0
and for incoherent scattering we ex-pect S(Z ,Q)→ Z as Q →∞
ZHe = 2 ZAr = 18 0 5 10 15 20
Q [Å-1
]
1
10
100
Inte
nsity
(in
uni
ts o
f r02 )
Ar
He
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 14 / 17
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Total atomic scattering
We can now write the total scatter-ing from an atom as the sum of twocomponents:(
dσ
dΩ
)el
∼ r20 |f (Q)|2(dσ
dΩ
)in
∼ r20S(Z ,Q)
recall that f (Q)→ Z as Q → 0
so |f (Q)|2 → Z 2 as Q → 0
and for incoherent scattering we ex-pect S(Z ,Q)→ Z as Q →∞
ZHe = 2 ZAr = 18 0 5 10 15 20
Q [Å-1
]
1
10
100
Inte
nsity
(in
uni
ts o
f r02 )
Ar
He
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 14 / 17
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Total atomic scattering
We can now write the total scatter-ing from an atom as the sum of twocomponents:(
dσ
dΩ
)el
∼ r20 |f (Q)|2(dσ
dΩ
)in
∼ r20S(Z ,Q)
recall that f (Q)→ Z as Q → 0
so |f (Q)|2 → Z 2 as Q → 0
and for incoherent scattering we ex-pect S(Z ,Q)→ Z as Q →∞
ZHe = 2 ZAr = 18 0 5 10 15 20
Q [Å-1
]
1
10
100
Inte
nsity
(in
uni
ts o
f r02 )
Ar
He
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 14 / 17
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Total atomic scattering
We can now write the total scatter-ing from an atom as the sum of twocomponents:(
dσ
dΩ
)el
∼ r20 |f (Q)|2(dσ
dΩ
)in
∼ r20S(Z ,Q)
recall that f (Q)→ Z as Q → 0
so |f (Q)|2 → Z 2 as Q → 0
and for incoherent scattering we ex-pect S(Z ,Q)→ Z as Q →∞
ZHe = 2 ZAr = 18 0 5 10 15 20
Q [Å-1
]
1
10
100
Inte
nsity
(in
uni
ts o
f r02 )
Ar
He
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 14 / 17
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Total atomic scattering
We can now write the total scatter-ing from an atom as the sum of twocomponents:(
dσ
dΩ
)el
∼ r20 |f (Q)|2(dσ
dΩ
)in
∼ r20S(Z ,Q)
recall that f (Q)→ Z as Q → 0
so |f (Q)|2 → Z 2 as Q → 0
and for incoherent scattering we ex-pect S(Z ,Q)→ Z as Q →∞
ZHe = 2 ZAr = 18
0 5 10 15 20
Q [Å-1
]
1
10
100
Inte
nsity
(in
uni
ts o
f r02 )
Ar
He
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 14 / 17
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Total atomic scattering
We can now write the total scatter-ing from an atom as the sum of twocomponents:(
dσ
dΩ
)el
∼ r20 |f (Q)|2(dσ
dΩ
)in
∼ r20S(Z ,Q)
recall that f (Q)→ Z as Q → 0
so |f (Q)|2 → Z 2 as Q → 0
and for incoherent scattering we ex-pect S(Z ,Q)→ Z as Q →∞
ZHe = 2 ZAr = 18 0 5 10 15 20
Q [Å-1
]
1
10
100
Inte
nsity
(in
uni
ts o
f r02 )
Ar
He
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 14 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA
= OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA
= OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA
= OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA
= OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA
= OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB
= OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB = OC
= OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB = OC = OD
= 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u
= −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z
= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
From the atomic form factor, wewould like to abstract to the nextlevel of complexity, a molecule (wewill leave crystals for Chapter 5).
Fmol(~Q) =∑j
fj(~Q)e i~Q·~r
As an example take the CF4
molecule
We have the following relation-ships:
OA = OB = OC = OD = 1
OA = OO ′ + O ′A
OB = OO ′ + O ′B
OA · OD = 1 · 1 · cos u = −z= OA · OB
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 15 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B
= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3
u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]
|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f Fsin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]
|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f Fsin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3R
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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Scattering from molecules
− z = (OO ′ + O ′A) · (OO ′ + O ′B)
= z2 + 0 + 0 + O ′A · O ′B= z2 + (O ′A)2 cos(120)
= z2 + (1− z2) cos(120)
= z2 − 1
2(1− z2)
0 = 3z2 + 2z − 1
z =1
3u = cos−1(−z) = 109.5
but from the triangle OO ′A
(O ′A)2 = 1− z2
Fmol± = f C (Q) + f F (Q)
[3e∓iQR/3 + e±iQR
]|Fmol |2 = |f C |2 + 4|f F |2 + 8f C f F
sin(QR)
QR+ 12|f F |2
sin(Q√
8/3R)
Q√
8/3RC. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 16 / 17
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The Radial Distribution Function
Ordered 2D crystal Amorphous solid or liquid
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The Radial Distribution Function
Ordered 2D crystal Amorphous solid or liquid
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The Radial Distribution Function
Ordered 2D crystal Amorphous solid or liquid
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The Radial Distribution Function
Ordered 2D crystal Amorphous solid or liquid
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The Radial Distribution Function
Ordered 2D crystal Amorphous solid or liquid
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The Radial Distribution Function
Ordered 2D crystal Amorphous solid or liquid
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The Radial Distribution Function
Ordered 2D crystal Amorphous solid or liquid
C. Segre (IIT) PHYS 570 - Fall 2016 October 03, 2016 17 / 17