mirror of https://github.com/lammps/lammps.git
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3395 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
parent
878f566983
commit
af2b887667
|
@ -19,7 +19,7 @@
|
|||
</P>
|
||||
<PRE>pair_style sw
|
||||
pair_coeff * * si.sw Si
|
||||
pair_coeff * * SiC.sw Si C Si
|
||||
pair_coeff * * GaN.sw Ga N Ga
|
||||
</PRE>
|
||||
<P><B>Description:</B>
|
||||
</P>
|
||||
|
@ -41,7 +41,7 @@ where N is the number of LAMMPS atom types:
|
|||
<UL><LI>filename
|
||||
<LI>N element names = mapping of SW elements to atom types
|
||||
</UL>
|
||||
<P>As an example, imagine the SiC.sw file has Stillinger-Weber values for
|
||||
<P>As an example, imagine a file SiC.sw has Stillinger-Weber values for
|
||||
Si and C. If your LAMMPS simulation has 4 atoms types and you want
|
||||
the 1st 3 to be Si, and the 4th to be C, you would use the following
|
||||
pair_coeff command:
|
||||
|
|
|
@ -16,7 +16,7 @@ pair_style sw :pre
|
|||
|
||||
pair_style sw
|
||||
pair_coeff * * si.sw Si
|
||||
pair_coeff * * SiC.sw Si C Si :pre
|
||||
pair_coeff * * GaN.sw Ga N Ga :pre
|
||||
|
||||
[Description:]
|
||||
|
||||
|
@ -38,7 +38,7 @@ where N is the number of LAMMPS atom types:
|
|||
filename
|
||||
N element names = mapping of SW elements to atom types :ul
|
||||
|
||||
As an example, imagine the SiC.sw file has Stillinger-Weber values for
|
||||
As an example, imagine a file SiC.sw has Stillinger-Weber values for
|
||||
Si and C. If your LAMMPS simulation has 4 atoms types and you want
|
||||
the 1st 3 to be Si, and the 4th to be C, you would use the following
|
||||
pair_coeff command:
|
||||
|
|
Loading…
Reference in New Issue