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Diffusion lammps (lammm-devel) Graph

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lammm-devel

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CommitAuthorDetailsCommitted
0377592bd58asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12595 f3b2605a-c512-4ea7… 
Oct 7 2014
82c5e92498c8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12594 f3b2605a-c512-4ea7… 
Oct 7 2014
e6f242658b00sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12593 f3b2605a-c512-4ea7… 
Oct 7 2014
16dcead2d21asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12592 f3b2605a-c512-4ea7… 
Oct 7 2014
fcad656d92d2sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12591 f3b2605a-c512-4ea7… 
Oct 7 2014
7c748bb17f8bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12590 f3b2605a-c512-4ea7… 
Oct 7 2014
352e1e9df418sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12589 f3b2605a-c512-4ea7… 
Oct 7 2014
621fa7d600d6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12588 f3b2605a-c512-4ea7… 
Oct 7 2014
4bb43ca88578athomps
Added warning to README file 
Oct 7 2014
f455fcb9b05bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12586 f3b2605a-c512-4ea7… 
Oct 7 2014
be637914ebb8sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12585 f3b2605a-c512-4ea7… 
Oct 7 2014
b64e7be6482csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12584 f3b2605a-c512-4ea7… 
Oct 6 2014
0d33aaee2d10sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12583 f3b2605a-c512-4ea7… 
Oct 6 2014
4d473aa47358sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12581 f3b2605a-c512-4ea7… 
Oct 1 2014
4f0b35ceeea7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12580 f3b2605a-c512-4ea7… 
Oct 1 2014
251660040393sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12579 f3b2605a-c512-4ea7… 
Oct 1 2014
8a517e353c67sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12578 f3b2605a-c512-4ea7… 
Oct 1 2014
60b877f75f84sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12577 f3b2605a-c512-4ea7… 
Oct 1 2014
1ae9826e6203sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12576 f3b2605a-c512-4ea7… 
Oct 1 2014
7266c83c2669sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12575 f3b2605a-c512-4ea7… 
Oct 1 2014
9705739cd016sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12574 f3b2605a-c512-4ea7… 
Oct 1 2014
036d813c7d71sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12573 f3b2605a-c512-4ea7… 
Oct 1 2014
495c49dbe26csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12572 f3b2605a-c512-4ea7… 
Sep 30 2014
7da99d44d84asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12571 f3b2605a-c512-4ea7… 
Sep 30 2014
bfd158da1b7bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12570 f3b2605a-c512-4ea7… 
Sep 30 2014
18d0508c5860sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12569 f3b2605a-c512-4ea7… 
Sep 30 2014
de171dbcc9e5sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12568 f3b2605a-c512-4ea7… 
Sep 26 2014
7b64253516e5sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12567 f3b2605a-c512-4ea7… 
Sep 26 2014
b1c711b508caathomps
Updated to MacPorts Open MPI 1.4.3 
Sep 26 2014
8ac96007c031athomps
Updated to MacPorts Open MPI 1.4.3 
Sep 26 2014
8fa22b4037ffsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12564 f3b2605a-c512-4ea7… 
Sep 26 2014
e8b64a9080fdstamoor
Fixed memory error in ewald_disp.cpp 
Sep 26 2014
bf8b5e4d630astamoor
Fixing broken basal example 
Sep 26 2014
62c95d86a8dcstamoor
Fixing broken USER-EFF example 
Sep 26 2014
5aedfd41b4c5sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12559 f3b2605a-c512-4ea7… 
Sep 26 2014
a0ec7efccfc7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12557 f3b2605a-c512-4ea7… 
Sep 26 2014
07ea6856a45dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12556 f3b2605a-c512-4ea7… 
Sep 26 2014
a6af1b44d0afsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12555 f3b2605a-c512-4ea7… 
Sep 26 2014
d3598ddb165bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12554 f3b2605a-c512-4ea7… 
Sep 26 2014
0d9fdf727d86sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12553 f3b2605a-c512-4ea7… 
Sep 25 2014
c7bd80910decsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12552 f3b2605a-c512-4ea7… 
Sep 25 2014
db47095d0cf4sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12551 f3b2605a-c512-4ea7… 
Sep 25 2014
2cd5ac0ce271sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12550 f3b2605a-c512-4ea7… 
Sep 25 2014
256e64887801sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12549 f3b2605a-c512-4ea7… 
Sep 25 2014
59720178d4b7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12548 f3b2605a-c512-4ea7… 
Sep 25 2014
56c532d58555sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12547 f3b2605a-c512-4ea7… 
Sep 25 2014
c720fca727e9sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12546 f3b2605a-c512-4ea7… 
Sep 25 2014
19229e55725bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12545 f3b2605a-c512-4ea7… 
Sep 25 2014
deb5b7c9870dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12544 f3b2605a-c512-4ea7… 
Sep 25 2014
0dd4b6580fefsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12543 f3b2605a-c512-4ea7… 
Sep 25 2014
dda702c5f952sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12542 f3b2605a-c512-4ea7… 
Sep 25 2014
39db21fe1c90sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12541 f3b2605a-c512-4ea7… 
Sep 25 2014
b0861454f53bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12540 f3b2605a-c512-4ea7… 
Sep 25 2014
07e74523384bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12539 f3b2605a-c512-4ea7… 
Sep 25 2014
0928f2338162sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12538 f3b2605a-c512-4ea7… 
Sep 25 2014
b135f236d66cPierre de Buyl
Allow optional author name in dump_h5md 
Sep 25 2014
94d539ee4f43Pierre de Buyl
do not write ch5md_SYS{INC,LIB} if HDF5_PATH not set 
Sep 25 2014
f64853170bb6sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12537 f3b2605a-c512-4ea7… 
Sep 25 2014
9482ac8cfe75sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12536 f3b2605a-c512-4ea7… 
Sep 25 2014
53467a25ef19sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12535 f3b2605a-c512-4ea7… 
Sep 24 2014
f62127f3739dsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12534 f3b2605a-c512-4ea7… 
Sep 24 2014
9bfef43a7b71Pierre de Buyl
Fix typo '-I' -> '-L' in Makefile 
Sep 24 2014
39e491cc255cPierre de Buyl
create build dir if it does not exist 
Sep 24 2014
ad2f33b61c90Pierre de Buyl
Update Makefile to generate properly Makefile.lammps 
Sep 24 2014
e1d881b11c54athomps
Update minimization documentation to reflect line quadratic default 
Sep 24 2014
fb705efa84ebathomps
Change fix box/relax example to be more efficient 
Sep 24 2014
463db5858357athomps
Made line quadratic default and changed backtrack alpha zero check to be more… 
Sep 24 2014
edd0d2dea75aathomps
Update minimization documentation to reflect line quadratic default 
Sep 24 2014
f45b388d1246stamoor
Fixing a bug in the kspace error estimator for triclinic systems 
Sep 24 2014
5d12a8fdab22sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12528 f3b2605a-c512-4ea7… 
Sep 23 2014
159d82e4730asjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12527 f3b2605a-c512-4ea7… 
Sep 23 2014
80c69a6b5654sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12526 f3b2605a-c512-4ea7… 
Sep 23 2014
c560bd50cb16sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12525 f3b2605a-c512-4ea7… 
Sep 23 2014
5ae8de8f47aastamoor
Fixing broken USER-INTEL examples 
Sep 22 2014
8ef1d7fdd03bPierre de Buyl
close HDF5 data only on root node 
Sep 22 2014
ad7b3caa04b4Pierre de Buyl
add restriction on domain shape 
Sep 22 2014
2b4a5fbfe63ePierre de Buyl
Generate error with triclinic domains 
Sep 22 2014
f4b333487962Pierre de Buyl
Update ch5md and close properly HDF5 identifiers (except file). 
Sep 22 2014
a1f0ecb25613Pierre de Buyl
Change the parsing of 'every' for dump_h5md 
Sep 22 2014
45223c452c84athomps
Updated diagnostics 
Sep 19 2014
7ce215970b4bathomps
Changed comment 
Sep 19 2014
d76a263ca74bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12521 f3b2605a-c512-4ea7… 
Sep 18 2014
dbb4fd7e7582sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12520 f3b2605a-c512-4ea7… 
Sep 18 2014
c60348da441bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12519 f3b2605a-c512-4ea7… 
Sep 18 2014
bda37b7c9873sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12518 f3b2605a-c512-4ea7… 
Sep 18 2014
c4241ba55c80sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12516 f3b2605a-c512-4ea7… 
Sep 18 2014
4ce180cbe2a3sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12515 f3b2605a-c512-4ea7… 
Sep 18 2014
e56b623e4c49sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12514 f3b2605a-c512-4ea7… 
Sep 18 2014
39373a22c3b5sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12513 f3b2605a-c512-4ea7… 
Sep 18 2014
e17948a19545sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12512 f3b2605a-c512-4ea7… 
Sep 17 2014
e015a68c10b6athomps
Added arXiv link 
Sep 17 2014
104106e2ecf9athomps
Added info on SNAP package to restrictions 
Sep 15 2014
847312aef6fdPierre de Buyl
Make current with respect to txt file. 
Sep 14 2014
ed9b130d6e40athomps
Added LAMMPS headers 
Sep 13 2014
d0b6d228c74csjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12508 f3b2605a-c512-4ea7… 
Sep 12 2014
16864ce4e3c7sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12507 f3b2605a-c512-4ea7… 
Sep 12 2014
4dd1b4fc6534sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12506 f3b2605a-c512-4ea7… 
Sep 12 2014
ae27db23fe17sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12505 f3b2605a-c512-4ea7… 
Sep 12 2014
89c7a5df328bsjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12504 f3b2605a-c512-4ea7… 
Sep 12 2014
40da76395508sjplimp
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12503 f3b2605a-c512-4ea7… 
Sep 11 2014
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