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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1930 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp 2008-06-25 13:35:54 +00:00
parent 0c442c3918
commit 0f3cd24537
2 changed files with 6 additions and 6 deletions
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6
doc/Section_howto.html
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@ -503,9 +503,9 @@ LJ epsilon, sigma of OH, HH = 0.0 <BR>
<P>r0 of OH bond = 1.0<BR>
theta of HOH angle = 109.47 <BR>
</P>
<P>To use TIP3P with a long-range Coulombic
solver (Ewald or PPPM in LAMMPS), the only parameters that
change are the partial charge assignments:
<P>To use SPC with a long-range Coulombic solver (Ewald or PPPM in
LAMMPS), the only parameters that change are the partial charge
assignments:
</P>
<P>O charge = -0.8476<BR>
H charge = 0.4238 <BR>

6
doc/Section_howto.txt
View File

@ -499,9 +499,9 @@ LJ epsilon, sigma of OH, HH = 0.0 :all(b),p
r0 of OH bond = 1.0
theta of HOH angle = 109.47 :all(b),p
To use TIP3P with a long-range Coulombic
solver (Ewald or PPPM in LAMMPS), the only parameters that
change are the partial charge assignments:
To use SPC with a long-range Coulombic solver (Ewald or PPPM in
LAMMPS), the only parameters that change are the partial charge
assignments:
O charge = -0.8476
H charge = 0.4238 :all(b),p