Diffusion lammps (master) History

lammps/test/02_commands
master48cf74f49ee8ea58909fb0f…

Jul 28 2016

add tests for anisotropic and triclinic box relaxation
55a138cdca6a
·Axel Kohlmeyer on Jul 28 2016, 22:47.

Jun 16 2016

update syntax in respa for fixes tests
51e86f6519dd
·Axel Kohlmeyer on Jun 16 2016, 23:55.

Jun 14 2016

3 new test cases to check adjusting the respa level for fixes
5a950e73bf89
·Axel Kohlmeyer on Jun 14 2016, 05:47.

Apr 23 2016

implement a write_coeff command to complement the recent nocoeff hacks
4482096c7b68
·Axel Kohlmeyer on Apr 23 2016, 05:09.

Apr 22 2016

use nocoeff keyword for skipping force field info when reading data file
823bb13c2b06
·Axel Kohlmeyer on Apr 22 2016, 03:18.
rename "nocoeffs" flag to "nocoeff" to be consistent with write_data
122523c51d32
·Axel Kohlmeyer on Apr 22 2016, 03:12.

Apr 21 2016

add test for new feature to read data files with force field data using zero…
c1ca20df49eb
·Axel Kohlmeyer on Apr 21 2016, 23:57.

Mar 29 2016

update tests for compute bond to match steve's changes
6e4c0fa95435
·Axel Kohlmeyer on Mar 29 2016, 13:43.

Mar 13 2016

add simple test for newly added compute bond command
6eb1ade2f0ad
·Axel Kohlmeyer on Mar 13 2016, 02:31.

Feb 18 2016

run all inputs twice: once with -screen none, onece with -log none
a8aadcc1dc25
·Axel Kohlmeyer on Feb 18 2016, 17:08.

Oct 27 2015

add some simple tests for displace_atoms
4ef17e113216
·Axel Kohlmeyer on Oct 27 2015, 00:15.

Oct 26 2015

add some simple tests for rerun.
58176fdc78c6
·Axel Kohlmeyer on Oct 26 2015, 13:32.

Oct 15 2015

add test for shake with one angle and two different bond lengths to constrain
b58667ce16bb
·Axel Kohlmeyer on Oct 15 2015, 22:54.

Sep 29 2015

add tests for dihedral style table culled from LAMMPS mail archive
6e53fc9e7dcd
·Axel Kohlmeyer on Sep 29 2015, 22:31.

Sep 28 2015

minimizer test cases
ef13e06a93c1
·Axel Kohlmeyer on Sep 28 2015, 17:32.

Sep 10 2015

finally re-enable r-RESPA tests and use is_active() to skip them for USER-OMP
06e347d0ee36
·Axel Kohlmeyer on Sep 10 2015, 23:28.

Sep 1 2015

add access to Universe::numver in info and variable
f3b15d6262e4
·Axel Kohlmeyer on Sep 1 2015, 00:03.

Aug 29 2015

adapt test inputs to "timers -> timer" command rename
02b9eeed5f18
·Axel Kohlmeyer on Aug 29 2015, 13:08.

Aug 26 2015

disable currently unsupported r-RESPA tests and re-enabled comm tests
01a5ea6fb935
·Axel Kohlmeyer on Aug 26 2015, 21:46.
disable comm_style related tests for now to validate if local test and CI agree
99c403139dbe
·Axel Kohlmeyer on Aug 26 2015, 17:52.
add test for deleting tally computes "in the middle". fails if not properly…
37c5db10afeb
·Axel Kohlmeyer on Aug 26 2015, 13:33.
correct path to data file.
ee18ec8ec217
·Axel Kohlmeyer on Aug 26 2015, 07:11.
more tests for recently added features
9a5265221c70
·Axel Kohlmeyer on Aug 26 2015, 04:23.

Aug 17 2015

test input for various run style respa options
b5320aceff42
·Axel Kohlmeyer on Aug 17 2015, 02:22.
added minimal tests for empty inputs and read_data
80ce074de02a
·Axel Kohlmeyer on Aug 17 2015, 02:10.
some more processors and load balancing inputs
59efd6cb7812
·Axel Kohlmeyer on Aug 17 2015, 00:21.
add some commands for communication and load balancing
75efe7da4593
·Axel Kohlmeyer on Aug 17 2015, 00:08.