Commits · 94dc5e1133dd647adce23dbdeae12b926c4a6ed0 · multiscale / lammps

Jun 14, 2017
- Added compute_scalar to fix_grem for easier output managment, updated example to show use · 0ad66ecb
  dstelter92 authored 7 years ago
  
  0ad66ecb
Mar 06, 2017
- Fix typos in src files · 7dd60f97
  Richard Berger authored 8 years ago
  
  7dd60f97
Nov 21, 2016
- small comment/whitespace tweak · 78932159
  Axel Kohlmeyer authored 8 years ago
  
  78932159
Nov 17, 2016
- added internal tempering in grem with example · 07e46b79
  dstelter92 authored 8 years ago
  
  07e46b79
Nov 14, 2016
- retrieve target temperature and pressure from fix npt. add sanity checks. · 14c7cf41
  Axel Kohlmeyer authored 8 years ago
  
  14c7cf41
Nov 13, 2016

initial import of adapted gREM code by David Stelter and Edyta Malolepsza · 20daf824

Axel Kohlmeyer authored 8 years ago

The following changes were made:
- the modifications to compute pressure were transferred to a derived class compute pressure/grem
- fix scaleforce was renamed to fix grem
- identifying the grem fix was simplified as fix grem passes an additional argument to compute pressure/grem
- dead code was removed in both files
- checking of arguments was tightened

20daf824

Jun 18, 2016

· d55f9684

sjplimp authored 8 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15203 f3b2605a-c512-4ea7-a41b-209d697bcdaa

d55f9684

Oct 21, 2014

· 7518fae9

sjplimp authored 10 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@12641 f3b2605a-c512-4ea7-a41b-209d697bcdaa

7518fae9

Jun 06, 2012

· ef9e7005

sjplimp authored 12 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8226 f3b2605a-c512-4ea7-a41b-209d697bcdaa

ef9e7005

Dec 16, 2011

· 891740f4

sjplimp authored 13 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7374 f3b2605a-c512-4ea7-a41b-209d697bcdaa

891740f4

Aug 19, 2010

· 5ff00cfd

sjplimp authored 14 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4505 f3b2605a-c512-4ea7-a41b-209d697bcdaa

5ff00cfd

Apr 23, 2010

· 86a0b517

sjplimp authored 15 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4032 f3b2605a-c512-4ea7-a41b-209d697bcdaa

86a0b517

· 7dbb6d50

sjplimp authored 15 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4028 f3b2605a-c512-4ea7-a41b-209d697bcdaa

7dbb6d50

Jan 12, 2010

· 2c643b7d

sjplimp authored 15 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3655 f3b2605a-c512-4ea7-a41b-209d697bcdaa

2c643b7d

Dec 15, 2009

· ff0a4b80

sjplimp authored 15 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3531 f3b2605a-c512-4ea7-a41b-209d697bcdaa

ff0a4b80

Aug 08, 2009

· cbdd9523

sjplimp authored 15 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@3028 f3b2605a-c512-4ea7-a41b-209d697bcdaa

cbdd9523

Aug 01, 2008

· 3c3bc8a0

sjplimp authored 16 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@2014 f3b2605a-c512-4ea7-a41b-209d697bcdaa

3c3bc8a0

Mar 17, 2008

· d4f14ea2

sjplimp authored 17 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1602 f3b2605a-c512-4ea7-a41b-209d697bcdaa

d4f14ea2

Jan 09, 2008

· b2b8adfa

sjplimp authored 17 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@1360 f3b2605a-c512-4ea7-a41b-209d697bcdaa

b2b8adfa

Jan 30, 2007

· 209f169c

sjplimp authored 18 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@254 f3b2605a-c512-4ea7-a41b-209d697bcdaa

209f169c

Sep 27, 2006

· 222c9550

sjplimp authored 18 years ago

git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@26 f3b2605a-c512-4ea7-a41b-209d697bcdaa

222c9550