Diffusion lammps (runner) History

USER
runner24fb679e5579b6fc906c801…

May 10 2014

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
24fb679e5579
·Axel Kohlmeyer on May 10 2014, 23:15.

May 9 2014

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11956 f3b2605a-c512-4ea7…
944b898d7128
·sjplimp on May 9 2014, 17:35.

May 2 2014

remove redundant files
86843200fdca
·Axel Kohlmeyer on May 2 2014, 22:24.

Apr 24 2014

update examples for USER-FEP
99f9652c492a
·Axel Kohlmeyer on Apr 24 2014, 23:46.

Apr 21 2014

reworked USER-FEP code to emit less warnings and be USER-OMP compatible
e04545e26d80
·Axel Kohlmeyer on Apr 21 2014, 23:16.

Apr 18 2014

add files missing from previous import of the project
89044ec1f89e
·Axel Kohlmeyer on Apr 18 2014, 20:43.
import USER-FEP package from https://github.com/agiliopadua/compute_fep
69c06791a580
·Axel Kohlmeyer on Apr 18 2014, 20:35.

Apr 16 2014

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
0a1f876f4e42
·Axel Kohlmeyer on Apr 16 2014, 00:13.

Apr 14 2014

Fixed broken basal example
1f0a6ae006ad
·stamoor on Apr 14 2014, 23:24.
Fixed broken examples by adding NULL after stess/atom commands
532a4e66fb6b
·stamoor on Apr 14 2014, 23:08.

Apr 9 2014

Merge remote branch 'lammps-ro/master' into lammps-icms
f8daecd639f4
·Axel Kohlmeyer on Apr 9 2014, 13:49.

Apr 8 2014

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11737 f3b2605a-c512-4ea7…
0b8bc83b4b9f
·sjplimp on Apr 8 2014, 18:57.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11736 f3b2605a-c512-4ea7…
a683e4f52d6f
·sjplimp on Apr 8 2014, 18:56.
Merge remote branch 'lammps-ro/master' into lammps-icms
fb3a956155f4
·Axel Kohlmeyer on Apr 8 2014, 12:56.

Apr 7 2014

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11730 f3b2605a-c512-4ea7…
23a0a72df1cd
·sjplimp on Apr 7 2014, 21:50.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11729 f3b2605a-c512-4ea7…
fe1d916552d2
·sjplimp on Apr 7 2014, 21:50.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11728 f3b2605a-c512-4ea7…
4f41258f5d81
·sjplimp on Apr 7 2014, 21:46.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11727 f3b2605a-c512-4ea7…
ea0dc9196302
·sjplimp on Apr 7 2014, 21:46.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@11726 f3b2605a-c512-4ea7…
944ffff4a9c8
·sjplimp on Apr 7 2014, 21:46.

Apr 5 2014

update the colvars example
dd00335813d7
·Axel Kohlmeyer on Apr 5 2014, 11:11.
add lj/sdk example with charges
ca7db502def3
·Axel Kohlmeyer on Apr 5 2014, 11:10.
update the PEG-C12E8 CG-CMM example for current LAMMPS version
4dae1d2d3b5d
·Axel Kohlmeyer on Apr 5 2014, 08:41.

Mar 25 2014

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
f80390891928
·Axel Kohlmeyer on Mar 25 2014, 16:10.

Mar 24 2014

in development : not for release
2fb6f59c9f68
·rjones on Mar 24 2014, 22:00.

Nov 9 2013

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
2e8da581f283
·Axel Kohlmeyer on Nov 9 2013, 10:55.

Nov 7 2013

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10990 f3b2605a-c512-4ea7…
bb589062a32b
·sjplimp on Nov 7 2013, 21:07.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10989 f3b2605a-c512-4ea7…
5c9784336738
·sjplimp on Nov 7 2013, 21:05.

Nov 5 2013

Merge remote branch 'lammps-ro/master' into lammps-icms
dc1278ee51e6
·Axel Kohlmeyer on Nov 5 2013, 13:37.

Nov 4 2013

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10956 f3b2605a-c512-4ea7…
90a2bccf8379
·sjplimp on Nov 4 2013, 21:54.

Oct 2 2013

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10846 f3b2605a-c512-4ea7…
ada81ca2e055
·sjplimp on Oct 2 2013, 15:29.

Sep 29 2013

update the input for current LAMMPS
78474bfe023c
·Axel Kohlmeyer on Sep 29 2013, 18:32.

Sep 13 2013

Merge remote branch 'lammps-ro/master' into lammps-icms
00d9f400ba98
·Axel Kohlmeyer on Sep 13 2013, 12:43.

Sep 12 2013

Removing "stdout" files
3d6369b7f526
·jzimmer on Sep 12 2013, 21:52.

Sep 5 2013

Merge remote branch 'lammps-ro/master' into lammps-icms
b46ddebe3eef
·Axel Kohlmeyer on Sep 5 2013, 14:02.

Sep 1 2013

ATC version 2.0, date: Sep1
5302074b3f8e
·rjones on Sep 1 2013, 10:07.

Aug 29 2013

Merge remote branch 'lammps-ro/master' into lammps-icms
2c30d74d8d0d
·Axel Kohlmeyer on Aug 29 2013, 16:14.
ATC version 2.0, date: Aug28
07e3b8c7d7d8
·rjones on Aug 29 2013, 00:16.

Aug 23 2013

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
1ca6fb0f8160
·Axel Kohlmeyer on Aug 23 2013, 13:31.
ATC version 2.0, date: Aug22
31b31f0a6ae6
·rjones on Aug 23 2013, 02:14.
not for release
eacdc7e58c63
·rjones on Aug 23 2013, 01:54.
ATC version 2.0, date: Aug22
a04f267b5449
·jzimmer on Aug 23 2013, 01:31.

Aug 22 2013

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
6297a32d9b46
·Axel Kohlmeyer on Aug 22 2013, 13:04.
Including info on cauchy_born examples.
2b9951bf5640
·jzimmer on Aug 22 2013, 02:22.
ATC version 2.0, date: Aug21
b22a8a7b61a5
·rjones on Aug 22 2013, 01:06.
Updated to current set of examples.
7d0fe14fdb33
·jatempl on Aug 22 2013, 00:57.
obsolete
2d63313b2479
·rjones on Aug 22 2013, 00:49.

Aug 14 2013

remove log file
546d3c4e6196
·rjones on Aug 14 2013, 03:55.

Aug 13 2013

remove unwanted file
8bbf508fb010
·Axel Kohlmeyer on Aug 13 2013, 06:27.

Aug 8 2013

Merge remote-tracking branch 'lammps-ro/master' into atc-merge
c931a450c093
·Axel Kohlmeyer on Aug 8 2013, 14:02.

Aug 7 2013

ATC version 2.0, date: Aug7
2629a8389dae
·rjones on Aug 7 2013, 23:34.
ATC version 2.0, date: Aug7
666de878addc
·rjones on Aug 7 2013, 23:29.

Jul 31 2013

Merge remote branch 'lammps-ro/master' into lammps-icms
77f06b1dfec1
·Axel Kohlmeyer on Jul 31 2013, 14:39.

Jul 30 2013

test if I can commit
13b38d09e55e
·rjones on Jul 30 2013, 23:52.

Jul 27 2013

Merge remote branch 'lammps-ro/master' into lammps-icms
9550535392c7
·Axel Kohlmeyer on Jul 27 2013, 12:34.

Jul 26 2013

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10409 f3b2605a-c512-4ea7…
b12b9fced98e
·sjplimp on Jul 26 2013, 17:38.

May 24 2013

improvements to serialization/deserialization feature
2e722ce5df91
·Axel Kohlmeyer on May 24 2013, 15:14.

Mar 12 2013

Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
8a912603a5f0
·Axel Kohlmeyer on Mar 12 2013, 18:44.

Mar 11 2013

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9632 f3b2605a-c512-4ea7…
a920f2320475
·sjplimp on Mar 11 2013, 21:47.

Jan 18 2013

Merge branch 'master' into lammps-icms
e1709a44891d
·Axel Kohlmeyer on Jan 18 2013, 13:50.

Jan 17 2013

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9278 f3b2605a-c512-4ea7…
87f2415519d6
·sjplimp on Jan 17 2013, 16:52.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9277 f3b2605a-c512-4ea7…
f51ad982f602
·sjplimp on Jan 17 2013, 16:51.

Jan 9 2013

Merge branch 'master' into lammps-icms
427161ef56aa
·Axel Kohlmeyer on Jan 9 2013, 13:09.

Jan 3 2013

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9204 f3b2605a-c512-4ea7…
772e83406ddd
·sjplimp on Jan 3 2013, 17:22.

Jan 2 2013

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9184 f3b2605a-c512-4ea7…
a69bbed0b75c
·sjplimp on Jan 2 2013, 17:48.

Oct 27 2012

Merge branch 'master' into lammps-icms
399871b63a07
·Axel Kohlmeyer on Oct 27 2012, 21:30.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9027 f3b2605a-c512-4ea7…
fbc3f58a054a
·sjplimp on Oct 27 2012, 01:31.

May 24 2012

Merge branch 'master' into lammps-icms
95f350087c9f
·Axel Kohlmeyer on May 24 2012, 15:03.

May 23 2012

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8163 f3b2605a-c512-4ea7…
44904c5bf3e6
·sjplimp on May 23 2012, 18:20.
update colvars test examples
e0d696f14da4
·Axel Kohlmeyer on May 23 2012, 02:00.

Apr 23 2012

expand test
9976610faadd
·Axel Kohlmeyer on Apr 23 2012, 19:54.

Mar 17 2012

update examples. no need for "auto" in fix spring.
8a744d26dc5c
·Axel Kohlmeyer on Mar 17 2012, 18:08.
update simple colvars example and compare to spring
f727b47017f1
·Axel Kohlmeyer on Mar 17 2012, 03:23.

Mar 13 2012

delete test input
0e33af4f94ea
·Axel Kohlmeyer on Mar 13 2012, 04:19.
colvars now working correctly in parallel
6456a5cb2d2e
·Axel Kohlmeyer on Mar 13 2012, 03:52.

Mar 8 2012

first fully working version of the colvars module
82a43ae07818
·Axel Kohlmeyer on Mar 8 2012, 03:06.

Mar 6 2012

added colvars test example
3a98d5829ef7
·Axel Kohlmeyer on Mar 6 2012, 03:52.

Jan 7 2012

documentation updates
4f1bc1a2da1c
·Axel Kohlmeyer on Jan 7 2012, 18:01.

Jan 6 2012

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7432 f3b2605a-c512-4ea7…
0af770b923af
·sjplimp on Jan 6 2012, 18:34.

Jan 5 2012

update and remove crud.
479db2297898
·Axel Kohlmeyer on Jan 5 2012, 20:41.

Jan 1 2012

Merge branch 'master' into lammps-icms
9259ae869929
·Axel Kohlmeyer on Jan 1 2012, 01:07.

Dec 1 2011

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7256 f3b2605a-c512-4ea7…
70a85bddfd2d
·sjplimp on Dec 1 2011, 15:58.

Aug 27 2011

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6836 f3b2605a-c512-4ea7…
91f494025059
·sjplimp on Aug 27 2011, 22:08.

Aug 8 2011

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6616 f3b2605a-c512-4ea7…
a2ea5509ff14
·sjplimp on Aug 8 2011, 21:01.

Jun 14 2011

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6379 f3b2605a-c512-4ea7…
c7e91e5418fb
·sjplimp on Jun 14 2011, 00:31.

Jun 1 2011

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@6272 f3b2605a-c512-4ea7…
63953173fd99
·sjplimp on Jun 1 2011, 02:01.

Feb 23 2011

Merge branch 'master' into lammps-icms
eac710420df6
·Axel Kohlmeyer on Feb 23 2011, 16:58.

Feb 22 2011

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5715 f3b2605a-c512-4ea7…
1d4a6440d108
·sjplimp on Feb 22 2011, 23:35.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@5714 f3b2605a-c512-4ea7…
f50885fd4625
·sjplimp on Feb 22 2011, 23:34.

Sep 2 2010

Merge branch 'master' into lammps-icms
ef3307c36988
·Axel Kohlmeyer on Sep 2 2010, 15:36.

Sep 1 2010

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4648 f3b2605a-c512-4ea7…
6ce7d46695c7
·sjplimp on Sep 1 2010, 20:55.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4647 f3b2605a-c512-4ea7…
7d832b4db101
·sjplimp on Sep 1 2010, 20:54.
add SWCNT plus buckyball demo for fix imd.
9f3153d089c1
·Axel Kohlmeyer on Sep 1 2010, 03:36.
update imd examples for new coordinate filtering
de6f8589f443
·Axel Kohlmeyer on Sep 1 2010, 03:33.

Aug 21 2010

Merge branch 'master' into lammps-icms
ae926d0adea3
·Axel Kohlmeyer on Aug 21 2010, 21:13.

Aug 20 2010

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4550 f3b2605a-c512-4ea7…
7c200a5fde06
·sjplimp on Aug 20 2010, 22:48.

Jul 22 2010

fix final glitch in tip4p specific ev_tally call
a5e119a1676a
·Axel Kohlmeyer on Jul 22 2010, 16:28.
add test input for tip4p water.
d3e8436b540b
·Axel Kohlmeyer on Jul 22 2010, 16:12.

Jun 20 2010

adapt pair style soft/omp to mainline changes.
dfb10b93110d
·Axel Kohlmeyer on Jun 20 2010, 23:52.

Jun 6 2010

add example/test input for granular pair styles.
805af3084403
·Axel Kohlmeyer on Jun 6 2010, 22:45.
added example input for colloid pair style. OpenMP seems to be broken
a4171a07fe7b
·Axel Kohlmeyer on Jun 6 2010, 03:53.

lammps/examples/USERrunner24fb679e5579b6fc906c801…

May 10 2014

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lammps/examples/USER
runner24fb679e5579b6fc906c801…