- Mar 06, 2017
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Richard Berger authored
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Richard Berger authored
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- Jan 17, 2017
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Steve Plimpton authored
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- Jan 16, 2017
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Axel Kohlmeyer authored
rather than adjusting the communication cutoff, we just print out the minimum value needed and error out i suspect, this communication cutoff adjustment was included into the code before it was possible to separately set it via comm_modify. stopping with an error message printing the needed/current value is cleaner, in keeping with other modules in LAMMPS and much less problematic.
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- Jan 13, 2017
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Axel Kohlmeyer authored
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Oliver Henrich authored
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- Jan 10, 2017
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Tim Mattox authored
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- Dec 22, 2016
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Tim Mattox authored
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Tim Mattox authored
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- Nov 22, 2016
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dstelter92 authored
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dstelter92 authored
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dstelter92 authored
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- Nov 21, 2016
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dstelter92 authored
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- Nov 18, 2016
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Axel Kohlmeyer authored
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- Nov 17, 2016
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dstelter92 authored
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dstelter92 authored
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dstelter92 authored
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dstelter92 authored
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dstelter92 authored
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dstelter92 authored
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dstelter92 authored
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- Nov 16, 2016
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Axel Kohlmeyer authored
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Axel Kohlmeyer authored
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- Nov 14, 2016
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Axel Kohlmeyer authored
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Axel Kohlmeyer authored
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Axel Kohlmeyer authored
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Axel Kohlmeyer authored
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- Nov 11, 2016
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Axel Kohlmeyer authored
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Axel Kohlmeyer authored
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- Oct 07, 2016
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Tim Mattox authored
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Tim Mattox authored
Includes documentation and examples. NOTE: VV requires very small timesteps under isoenergetic conditions. Consider using fix_shardlow instead, since this VV support is primarily for comparison purposes.
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- Oct 06, 2016
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A Bartok-Partay authored
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- Sep 21, 2016
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Axel Kohlmeyer authored
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- Sep 20, 2016
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Steve Plimpton authored
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sjplimp authored
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15604 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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- Aug 27, 2016
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Steve Plimpton authored
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sjplimp authored
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15508 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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- Aug 23, 2016
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sjplimp authored
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15489 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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Axel Kohlmeyer authored
Submitted by Steven E. Strong via github Contributing authors: Steven E. Strong and Joel D. Eaves Joel.Eaves@Colorado.edu This branch implements Gaussian dynamics (GD), which is a method to do nonequilibrium molecular dynamics simulations of steady-state flow. See http://dx.doi.org/10.1021/acs.jpclett.6b00748. It is simple to implement and derives rigorously from Gauss's principle of least constraint. (cherry picked from commit 75929ee01b7c34a15e3e2ed3e8e0cbff85fe50dd)
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- Aug 22, 2016
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Axel Kohlmeyer authored
(cherry picked from commit 433741564d166a5535bebf0e2487db6788d7871e)
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