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Merge pull request #417 from tonnamb/add-pair-zhou

Authored by sjplimp <sjplimp@sandia.gov> on Mar 24 2017, 16:41.

Description

Merge pull request #417 from tonnamb/add-pair-zhou

add new pair potential for metal-organic interactions - pair style momb

Event Timeline

GitHub <noreply@github.com> committed rLAMMPS277b93cb8956: Merge pull request #417 from tonnamb/add-pair-zhou (authored by sjplimp <sjplimp@sandia.gov>).Mar 24 2017, 16:41

Merged Changes

CommitAuthorDetailsCommitted
568b67eee9cbAxel Kohlmeyer
include citation for reference paper into pair style momb 
Mar 23 2017
865b41e2014eAxel Kohlmeyer
make pair style momb example follow LAMMPS conventions more closely 
Mar 23 2017
b88a7496808bAxel Kohlmeyer
rename a couple more references to pair style zhou into momb 
Mar 23 2017
02e65900e6efTonnam Balankura
add example log file generated from 17Nov16 version of lammps, make minimize… 
Mar 23 2017
343c9eda82d3Tonnam Balankura
change zhou to momb in src/USER-MISC/README 
Mar 23 2017
df8dbec67653Tonnam Balankura
rename pair_zhou to pair_momb in src and change class name from PairZhou to… 
Mar 23 2017
1075be7eca96Tonnam Balankura
rename zhou to momb in examples 
Mar 23 2017
6d395ec511b3Tonnam Balankura
change name zhou to momb in docs, fix grammar 
Mar 23 2017
bf560e78f348Tonnam Balankura
edit description and add related commands and default 
Mar 22 2017
daae76c46505Tonnam Balankura
Add names Tonnam and Ya to README 
Mar 22 2017
1ea9a14121caTonnam Balankura
Add Tonnam and Ya names 
Mar 22 2017
1db5834b99d0Axel Kohlmeyer
Revert "Cleanup of a few more references to obsoleted and removed tools like… 
Mar 22 2017
3070b043be1bAxel Kohlmeyer
Revert "correct inconsistent anchors" 
Mar 22 2017
ef3f323fc47dAxel Kohlmeyer
Revert "remove reference to removed section on VMD scripts" 
Mar 22 2017
dc1d93a49108Axel Kohlmeyer
some more whitespace cleanup 
Mar 22 2017
66eb9c248620Axel Kohlmeyer
remove reference to removed section on VMD scripts 
Mar 22 2017
a14d58259c3eAxel Kohlmeyer
correct inconsistent anchors 
Mar 22 2017
127597023df5Axel Kohlmeyer
Cleanup of a few more references to obsoleted and removed tools like xmovie 
Mar 22 2017
cb9059652daaAxel Kohlmeyer
a few more small changes to integrate pair style zhou properly 
Mar 22 2017
43f27250b5a5Axel Kohlmeyer
Merge branch 'add-pair-zhou' of https://github.com/tonnamb/lammps into pull-417 
Mar 22 2017
c5d561a31260Tonnam Balankura
pair_zhou docs: add equation, add link in section_commands and pairs 
Mar 22 2017
52987a36158bTonnam Balankura
Started writing pair_zhou.txt 
Mar 19 2017
b6ecfb91c447Tonnam Balankura
deleted pair_zhou in main/src (moved to USER-MISC) 
Mar 19 2017
d04ea8653deaTonnam Balankura
add examples for pair_zhou 
Mar 19 2017
2ab77caa8bedTonnam Balankura
adapt to LAMMPS coding style 
Mar 19 2017
da81531906d3Tonnam Balankura
move pair_zhou to USER-MISC and update USER-MISC/README 
Mar 19 2017
5be32f5d8d6bTonnam Balankura
remove pair_zhou from Makefile.list 
Mar 19 2017
ec1778b586b8Tonnam Balankura
add pair_zhou 
Mar 15 2017