| File |
Last Change
|
|---|---|
 ../
|
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scripts/
|
622 (22 years ago) by mmeineke: added a quick wipe-and-update script for quick rebuilds on BoB |
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samples/
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673 (22 years ago) by chuckv: EAM works...... Neighbor list also works..... |
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ac-tools/
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679 (22 years ago) by chuckv: added utils/sysbuilder to be built. |
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forceFields/
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688 (22 years ago) by gezelter: formatting fixes and new atypes in LJFF |
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src/
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718 (22 years ago) by gezelter: *** empty log message *** |
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libBASS/
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718 (22 years ago) by gezelter: *** empty log message *** |
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utils/
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724 (22 years ago) by mmeineke: added define statemewnt to Statwriter and Dumpwriter to handle files larger than 2 gb. commented out some print statements in Zconstraint hard coding some system init into bilayer.sys |
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libmdtools/
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733 (22 years ago) by tim: fix bug of MPI_Allreduce in ZConstraint, the MPITYPE is set to MPI_DOUBLE, however, the corret type is MPI_INT. Therefore, when we turn on the optimization flag, it causes a seg fault |
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props/
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735 (22 years ago) by mmeineke: added the first functional parts of the PairCorrType Abstract classes. |
NEWS
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378 (23 years ago) by mmeineke: This commit was generated by cvs2svn to compensate for changes in r377, which included commits to RCS files with non-trunk default branches. |
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AUTHORS
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378 (23 years ago) by mmeineke: This commit was generated by cvs2svn to compensate for changes in r377, which included commits to RCS files with non-trunk default branches. |
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LICENSE
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384 (23 years ago) by gezelter: Added license file |
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README
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444 (23 years ago) by gezelter: Changed Readme, added some files |
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Makefile
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720 (22 years ago) by mmeineke: changed the Makefiel a litle. |
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ChangeLog
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727 (22 years ago) by tim: fix bug in calc_dipole_dipole.F90 and calc_stikcy_pair.F90 molMembershipList use global index instead of local index |