hackdaworld.org Git - physik/posic.git/atom logUnnamed repository; edit this file to name it for gitweb.https://hackdaworld.org/gitweb/?p=physik/posic.gitFrankstatic/git-favicon.pngstatic/git-logo.png2012-02-20T15:55:56ZgitwebMerge branch 'leadoff'2012-02-20T15:55:56Zhackbardhackbard@hackdaworld.orghackbardhackbard@hackdaworld.org2012-02-20T15:55:56Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=6e6d7126ea9a845f11637d8e1b8eb2b570ac4dc9
Merge branch 'leadoff'
Conflicts:
Makefile
moldyn.c
potentials/albe.c
potentials/albe.h
runmd
... hopefully fixed! Just a test to merge leadoff back to master! :)
energy updates2011-07-12T08:34:00Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2011-07-12T08:34:00Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=98df942a2412e6ace72ae221f2e967f24bba7108
some more files2011-07-12T07:22:59Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2011-07-12T07:22:59Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=a29f0d8f1217a53ac4e1b90e65d24394f7c8967f
feature to del atoms outside a spherical volume2011-07-11T11:38:08Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2011-07-11T11:38:08Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=8e2583bfb346f0f054cf0f2ca35f25cd20a6f8d4
final crt fixes (velocity?)2010-10-14T12:38:56Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-10-14T12:38:56Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=c4a2ca467fd4157107bdde0706c2394962b68ee3
tool to build crude interface for vasp2010-07-13T20:26:16Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-07-13T20:26:16Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=7ffcb7c7b0cddea0a0a9cce32cf91cfb544368e7
introduced crt type 2 (initial diplacement vector for constraints) + write out crt... 2010-05-20T14:54:35Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-05-20T14:54:35Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=fe84cdc3fc897581636aff89b6f4fd12db1d2718
introduced crt type 2 (initial diplacement vector for constraints) + write out crt save files
started with crt ...2010-05-18T15:46:18Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-05-18T15:46:18Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=bc17c58e6e7c5adde9e7cf89efd6dfe37147446d
mus out of mu Si and mu SiC (Tersoff way)2010-03-23T16:39:25Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-03-23T16:39:25Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=d24930a9135ffd5927fbf65a71494f5cf772f264
some checkins2010-03-23T16:38:33Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-03-23T16:38:33Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=8524173a28f2c22a539ef1b0910a1136d9cb254b
added acos to angle calc2010-03-23T16:32:19Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-03-23T16:32:19Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=40f91e7d7cb98fedd86bc4e3178021f687190550
small fx and new features2010-03-04T12:03:35Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-03-04T12:03:35Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=83fc5a2dccab15ccce5a579ca4b4975c4614e816
added the all stoms crt patch2010-02-08T13:24:12Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-02-08T13:24:12Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=839a6628d140c5c32c108d63ce59b4c7fa2b8858
added angle calc (acos problem still existing)2010-01-27T17:08:30Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-01-27T17:08:30Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=4b51fdc9537cc3bf389d7b596bc8dbd973ad157e
added sip and dist calc for vasp results2010-01-27T16:02:11Zhackbardhackbard@sage.physik.uni-augsburg.dehackbardhackbard@sage.physik.uni-augsburg.de2010-01-27T16:02:11Zhttps://hackdaworld.org/gitweb/?p=physik/posic.git;a=commitdiff;h=b12edd667bd8891f871975590d6fd45e843bd1e0