Diffusion lammps (lammm-master) History

lammps/src
lammm-master550be1d5129eee2d1459bf5…

Nov 10 2015

got rid of std:complex_literals i1
a61df922c3b8
·athomps on Nov 10 2015, 17:47.

Nov 7 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14245 f3b2605a-c512-4ea7…
6d6d8345bf00
·sjplimp on Nov 7 2015, 22:07.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14243 f3b2605a-c512-4ea7…
b741a7771217
·sjplimp on Nov 7 2015, 22:03.

Nov 5 2015

Added hexatic bond orientational order parameter
fa9af07140ba
·athomps on Nov 5 2015, 07:58.
Added hexatic bond orientational order parameter
3bc7350704d2
·athomps on Nov 5 2015, 07:53.
Added hexatic bond orientational order parameter
4f71701e4ef2
·athomps on Nov 5 2015, 02:33.
Added hexatic bond orientational order parameter
a91bbaf7f276
·athomps on Nov 5 2015, 00:56.

Nov 4 2015

Added hexatic bond orientational order parameter
f227080d703c
·athomps on Nov 4 2015, 06:18.

Oct 31 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14227 f3b2605a-c512-4ea7…
34e1f5c71e86
·sjplimp on Oct 31 2015, 00:45.

Oct 30 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14225 f3b2605a-c512-4ea7…
a2481116c573
·sjplimp on Oct 30 2015, 23:52.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14221 f3b2605a-c512-4ea7…
260d9f419260
·sjplimp on Oct 30 2015, 21:14.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7…
354e20f43157
·sjplimp on Oct 30 2015, 21:04.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14215 f3b2605a-c512-4ea7…
628190cbcb86
·sjplimp on Oct 30 2015, 15:52.

Oct 23 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14207 f3b2605a-c512-4ea7…
0035a690d15b
·sjplimp on Oct 23 2015, 21:46.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14200 f3b2605a-c512-4ea7…
ff974eb07779
·sjplimp on Oct 23 2015, 19:16.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14197 f3b2605a-c512-4ea7…
08157510b702
·sjplimp on Oct 23 2015, 19:00.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14196 f3b2605a-c512-4ea7…
e53f61a8691b
·sjplimp on Oct 23 2015, 16:53.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14191 f3b2605a-c512-4ea7…
021a327e851a
·sjplimp on Oct 23 2015, 02:46.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14187 f3b2605a-c512-4ea7…
9057c423506f
·sjplimp on Oct 23 2015, 02:30.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14180 f3b2605a-c512-4ea7…
b45a8bb7e3d9
·sjplimp on Oct 23 2015, 02:04.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14176 f3b2605a-c512-4ea7…
9cf48b934967
·sjplimp on Oct 23 2015, 01:41.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14175 f3b2605a-c512-4ea7…
d815b390baf1
·sjplimp on Oct 23 2015, 01:39.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14173 f3b2605a-c512-4ea7…
cfbe572aa5a7
·sjplimp on Oct 23 2015, 01:03.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14172 f3b2605a-c512-4ea7…
0eb2e8f9cb98
·sjplimp on Oct 23 2015, 00:56.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14166 f3b2605a-c512-4ea7…
0068c45c803d
·sjplimp on Oct 23 2015, 00:09.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14164 f3b2605a-c512-4ea7…
cee848f94865
·sjplimp on Oct 23 2015, 00:06.

Oct 22 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14163 f3b2605a-c512-4ea7…
b229c719d0d3
·sjplimp on Oct 22 2015, 23:48.
Small tweak for compatibility with different versions of lscpu
1eeeb028f914
·stamoor on Oct 22 2015, 21:05.
Fixed problem with box flips under NVT
066e7598c9b6
·athomps on Oct 22 2015, 01:20.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14158 f3b2605a-c512-4ea7…
e512ca27a7e6
·sjplimp on Oct 22 2015, 01:14.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14157 f3b2605a-c512-4ea7…
46e7b6417603
·sjplimp on Oct 22 2015, 01:13.

Oct 21 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14156 f3b2605a-c512-4ea7…
4ce32a301c7d
·sjplimp on Oct 21 2015, 23:23.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14155 f3b2605a-c512-4ea7…
bc1cf9965e75
·sjplimp on Oct 21 2015, 23:20.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14152 f3b2605a-c512-4ea7…
a2604e221e48
·sjplimp on Oct 21 2015, 23:01.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14151 f3b2605a-c512-4ea7…
5775cf2f9355
·sjplimp on Oct 21 2015, 23:00.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14148 f3b2605a-c512-4ea7…
50733f2482ae
·sjplimp on Oct 21 2015, 22:18.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14147 f3b2605a-c512-4ea7…
3830813864c4
·sjplimp on Oct 21 2015, 21:58.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14144 f3b2605a-c512-4ea7…
87ae4919a958
·sjplimp on Oct 21 2015, 21:55.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14143 f3b2605a-c512-4ea7…
1953fd7feea0
·sjplimp on Oct 21 2015, 21:55.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14142 f3b2605a-c512-4ea7…
7163eaf6005f
·sjplimp on Oct 21 2015, 21:42.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14139 f3b2605a-c512-4ea7…
8a10c55a3b2c
·sjplimp on Oct 21 2015, 21:39.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14138 f3b2605a-c512-4ea7…
abe4c06219b8
·sjplimp on Oct 21 2015, 21:34.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14135 f3b2605a-c512-4ea7…
b036260091bd
·sjplimp on Oct 21 2015, 21:28.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14134 f3b2605a-c512-4ea7…
d145ae099ed8
·sjplimp on Oct 21 2015, 21:27.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14129 f3b2605a-c512-4ea7…
ef82677cb25c
·sjplimp on Oct 21 2015, 20:51.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14128 f3b2605a-c512-4ea7…
9a878cdd6718
·sjplimp on Oct 21 2015, 20:29.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14126 f3b2605a-c512-4ea7…
b2c2e38ba396
·sjplimp on Oct 21 2015, 20:09.
Added vashishta to USER-OMP from Axel
bf26b12668a4
·athomps on Oct 21 2015, 05:57.

Oct 19 2015

Added Xiong's name and cleaned up code
45a91eaded08
·athomps on Oct 19 2015, 19:20.
Made molecule ID for molecule group to minus 1
7b16c435b6c2
·athomps on Oct 19 2015, 19:19.

Oct 16 2015

Fixed MINe type
9025f65fad7d
·athomps on Oct 16 2015, 20:37.

Oct 15 2015

Require type argument be zero when mol keyword used
ce6210557023
·athomps on Oct 15 2015, 23:02.
Added acknowledgement for Xiong
2675f362e17d
·athomps on Oct 15 2015, 23:00.
Propoaged SW cutoff fix into similar code elsewhere
834731ddb4f4
·athomps on Oct 15 2015, 20:41.
Added Vashishta potential
c7170a4296b4
·athomps on Oct 15 2015, 19:39.
Protected against numerical overflow at cutoff
aa6624c029fd
·athomps on Oct 15 2015, 02:12.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14114 f3b2605a-c512-4ea7…
d4870cd69f7c
·sjplimp on Oct 15 2015, 01:20.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14113 f3b2605a-c512-4ea7…
5f1eddedcf1c
·sjplimp on Oct 15 2015, 01:19.

Oct 13 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14112 f3b2605a-c512-4ea7…
b437d74c75c0
·sjplimp on Oct 13 2015, 22:07.
added tfac_insert keyword and changed molecule insertion velocities PRNG
537e951c6d8d
·athomps on Oct 13 2015, 17:54.

Oct 7 2015

Added deprecated warning message to pair_style reax
dcb68f4c9786
·athomps on Oct 7 2015, 22:20.

Oct 5 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14094 f3b2605a-c512-4ea7…
bb48e4789521
·sjplimp on Oct 5 2015, 17:32.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14093 f3b2605a-c512-4ea7…
c7842922980b
·sjplimp on Oct 5 2015, 17:25.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14092 f3b2605a-c512-4ea7…
5fa97f537abd
·sjplimp on Oct 5 2015, 17:25.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14091 f3b2605a-c512-4ea7…
fa6ad89b99ab
·sjplimp on Oct 5 2015, 17:20.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14088 f3b2605a-c512-4ea7…
56ee1b670b3b
·sjplimp on Oct 5 2015, 17:13.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14087 f3b2605a-c512-4ea7…
6f038ab6d04d
·sjplimp on Oct 5 2015, 17:10.

Oct 2 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14086 f3b2605a-c512-4ea7…
3f3165af39fd
·sjplimp on Oct 2 2015, 21:54.

Oct 1 2015

Fixed negligible error in Tersoff and COMB
e5514189ba45
·athomps on Oct 1 2015, 01:00.

Sep 28 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14082 f3b2605a-c512-4ea7…
a6d7932ef46a
·sjplimp on Sep 28 2015, 14:37.

Sep 25 2015

Tweak to Kokkos Cuda Makefile allowing it to automatically find the nvcc wrapper
4f4ba3f7bf3e
·stamoor on Sep 25 2015, 20:12.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14076 f3b2605a-c512-4ea7…
f384db5c2eee
·sjplimp on Sep 25 2015, 00:54.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14074 f3b2605a-c512-4ea7…
8fd8c25e7c3f
·sjplimp on Sep 25 2015, 00:52.

Sep 24 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14071 f3b2605a-c512-4ea7…
ef4e8f288aa4
·sjplimp on Sep 24 2015, 22:57.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14068 f3b2605a-c512-4ea7…
9bdec3026069
·sjplimp on Sep 24 2015, 22:44.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14065 f3b2605a-c512-4ea7…
d2ee16c936ce
·sjplimp on Sep 24 2015, 22:35.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14064 f3b2605a-c512-4ea7…
546186739cec
·sjplimp on Sep 24 2015, 22:34.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14061 f3b2605a-c512-4ea7…
53a8a038e82b
·sjplimp on Sep 24 2015, 22:24.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14058 f3b2605a-c512-4ea7…
448b9f66f0fa
·sjplimp on Sep 24 2015, 22:18.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14053 f3b2605a-c512-4ea7…
a6ff24caa3fb
·sjplimp on Sep 24 2015, 22:01.
Slight tweak to Kokkos Cuda Makefile
0cc260a1aff4
·stamoor on Sep 24 2015, 01:06.

Sep 23 2015

Modifed ZBL to accomodate mixing
fe3c6670f6b4
·athomps on Sep 23 2015, 02:30.

Sep 18 2015

Fixed problem with read_dump xyz
ca55525283f0
·athomps on Sep 18 2015, 23:16.

Sep 12 2015

Made insertion work correctly for triclinic
ed7559f32957
·athomps on Sep 12 2015, 18:41.
Fixed triclinic bug in gcmc and qtype bug atom/swap
5cbf3cfba5f1
·athomps on Sep 12 2015, 01:09.

Sep 11 2015

Fixed triclinic bug in gcmc and qtype bug atom/swap
54210d7a9b2f
·athomps on Sep 11 2015, 23:47.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14032 f3b2605a-c512-4ea7…
41ef5b75a95a
·sjplimp on Sep 11 2015, 17:05.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14029 f3b2605a-c512-4ea7…
d32cd3cf51ee
·sjplimp on Sep 11 2015, 17:03.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14028 f3b2605a-c512-4ea7…
d9d9a2a496f2
·sjplimp on Sep 11 2015, 16:54.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14025 f3b2605a-c512-4ea7…
9effcca0df71
·sjplimp on Sep 11 2015, 16:49.

Sep 9 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14022 f3b2605a-c512-4ea7…
8fe7c3d47f76
·sjplimp on Sep 9 2015, 16:05.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14021 f3b2605a-c512-4ea7…
ebbc55b98892
·sjplimp on Sep 9 2015, 16:04.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14016 f3b2605a-c512-4ea7…
556bde6dc1b0
·sjplimp on Sep 9 2015, 02:02.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14015 f3b2605a-c512-4ea7…
abbf8d2878c8
·sjplimp on Sep 9 2015, 01:58.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14014 f3b2605a-c512-4ea7…
11fea8576926
·sjplimp on Sep 9 2015, 01:55.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14013 f3b2605a-c512-4ea7…
71054c590af3
·sjplimp on Sep 9 2015, 01:55.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14012 f3b2605a-c512-4ea7…
9aac00e7ed5c
·sjplimp on Sep 9 2015, 01:55.

Sep 3 2015

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13995 f3b2605a-c512-4ea7…
daff294b03df
·sjplimp on Sep 3 2015, 02:19.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13992 f3b2605a-c512-4ea7…
a3017bc09291
·sjplimp on Sep 3 2015, 02:14.
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13990 f3b2605a-c512-4ea7…
7420059d7687
·sjplimp on Sep 3 2015, 02:08.

lammps/srclammm-master550be1d5129eee2d1459bf5…

Nov 10 2015

Nov 7 2015

Nov 5 2015

Nov 4 2015

Oct 31 2015

Oct 30 2015

Oct 23 2015

Oct 22 2015

Oct 21 2015

Oct 19 2015

Oct 16 2015

Oct 15 2015

Oct 13 2015

Oct 7 2015

Oct 5 2015

Oct 2 2015

Oct 1 2015

Sep 28 2015

Sep 25 2015

Sep 24 2015

Sep 23 2015

Sep 18 2015

Sep 12 2015

Sep 11 2015

Sep 9 2015

Sep 3 2015

lammps/src
lammm-master550be1d5129eee2d1459bf5…