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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@244 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp 2007-01-17 23:59:33 +00:00
parent 7c6b478472
commit 6466fa0980
4 changed files with 18 additions and 6 deletions
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7
doc/pair_style_sw.html
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@ -67,7 +67,7 @@ and three-body coefficients in the formula above:
<LI>element 2 <LI>element 2
<LI>element 3 <LI>element 3
<LI>epsilon (energy units) <LI>epsilon (energy units)
<LI>sigma (distnace units) <LI>sigma (distance units)
<LI>a <LI>a
<LI>lambda <LI>lambda
<LI>gamma <LI>gamma
@ -77,7 +77,10 @@ and three-body coefficients in the formula above:
<LI>p <LI>p
<LI>q <LI>q
</UL> </UL>
<P>The non-annotated parameters are unitless. <P>The epsilon, sigma, a, A, B, p, and q parameters are two-body
interaction parameters. The lambda, gamma, and costheta0 parameters
are three-body interaction parameters. The non-annotated parameters
are unitless.
</P> </P>
<P>The Stillinger-Weber potential file must contain entries for all the <P>The Stillinger-Weber potential file must contain entries for all the
elements listed in the pair_coeff command. It can also contain elements listed in the pair_coeff command. It can also contain

7
doc/pair_style_sw.txt
View File

@ -64,7 +64,7 @@ element 1 (the center atom in a 3-body interaction)
element 2 element 2
element 3 element 3
epsilon (energy units) epsilon (energy units)
sigma (distnace units) sigma (distance units)
a a
lambda lambda
gamma gamma
@ -74,7 +74,10 @@ B
p p
q :ul q :ul
The non-annotated parameters are unitless. The epsilon, sigma, a, A, B, p, and q parameters are two-body
interaction parameters. The lambda, gamma, and costheta0 parameters
are three-body interaction parameters. The non-annotated parameters
are unitless.
The Stillinger-Weber potential file must contain entries for all the The Stillinger-Weber potential file must contain entries for all the
elements listed in the pair_coeff command. It can also contain elements listed in the pair_coeff command. It can also contain

5
doc/pair_style_tersoff.html
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@ -79,7 +79,10 @@ above:
<LI>lambda1 (1/distance units) <LI>lambda1 (1/distance units)
<LI>A (energy units) <LI>A (energy units)
</UL> </UL>
<P>The non-annotated parameters are unitless. <P>The n, beta, lambda2, B, R, D, lambda1, and A parameters are two-body
interaction parameters. The lambda3, c, d, and costheta0 parameters
are three-body interaction parameters. The non-annotated parameters
are unitless.
</P> </P>
<P>The Tersoff potential file must contain entries for all the elements <P>The Tersoff potential file must contain entries for all the elements
listed in the pair_coeff command. It can also contain entries for listed in the pair_coeff command. It can also contain entries for

5
doc/pair_style_tersoff.txt
View File

@ -76,7 +76,10 @@ D (distance units)
lambda1 (1/distance units) lambda1 (1/distance units)
A (energy units) :ul A (energy units) :ul
The non-annotated parameters are unitless. The n, beta, lambda2, B, R, D, lambda1, and A parameters are two-body
interaction parameters. The lambda3, c, d, and costheta0 parameters
are three-body interaction parameters. The non-annotated parameters
are unitless.
The Tersoff potential file must contain entries for all the elements The Tersoff potential file must contain entries for all the elements
listed in the pair_coeff command. It can also contain entries for listed in the pair_coeff command. It can also contain entries for