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Added protection against using charges without full_energy

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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13539 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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athomps
2015-07-07 23:58:59 +00:00
parent c368b5f988
commit 1d04d83b1e
2 changed files with 4 additions and 2 deletions
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doc/fix_gcmc.html
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@ -218,7 +218,8 @@ potential energy calculations, including the following:
<LI> many-body pair styles
<LI> hybrid pair styles
<LI> eam pair styles
<LI> triclinic systems
<LI> triclinic systems
<LI> charged systems (b/c single() function for Coulombic pair styles requires an atom index to look up charges)
<LI> need to include potential energy contributions from other fixes
</UL>
<P>In these cases, LAMMPS will automatically apply the <I>full_energy</I>

3
doc/fix_gcmc.txt
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@ -203,7 +203,8 @@ potential energy calculations, including the following:
many-body pair styles
hybrid pair styles
eam pair styles
triclinic systems
triclinic systems
charged systems (b/c single() function for Coulombic pair styles requires an atom index to look up charges)
need to include potential energy contributions from other fixes :ul
In these cases, LAMMPS will automatically apply the {full_energy}