lammps

Author	SHA1	Message	Date
julient31	0bb2e004ab	Commit JT 042919 - corrections Axel 1	2019-04-29 08:08:56 -06:00
Axel Kohlmeyer	d190b76075	remove unused custom constructor	2019-04-27 13:22:14 -04:00
Axel Kohlmeyer	930748f6f2	change neb/spin class names to better match the conventions used in the rest of LAMMPS	2019-04-27 13:16:37 -04:00
Axel Kohlmeyer	6fc2bda01c	some whitespace cleanup	2019-04-27 07:52:25 -04:00
julient31	7c3f619e13	Commit JT 042519 - moved examples/SPIN/gneb/interpolate/ toward tools/spin/interpolate/gneb - added gneb in the command files in doc/src - modified the error messages in neb_spin.h/cpp	2019-04-25 09:18:33 -06:00
julient31	57247142d2	Commit2 JT 040819 - finished doc (compiled and spell check) - compiled with -Wall -Wextra, unused var. removed	2019-04-08 11:08:06 -06:00
julient31	da16a7e50b	Commit JT 040519 - initial rotation with Rodrigues' formula + exception - worked on neb_spin documentation - removed pair/spin warning for neb/spin	2019-04-05 13:22:46 -06:00
julient31	e45e92b1cb	Commit JT 040319 - improved examples - start rework gneb init. (Rodrigues' formula)	2019-04-03 11:24:37 -06:00
julient31	0b8332cedf	Commit2 JT 040119 - improved verbose output - work on examples	2019-04-01 17:52:59 -06:00
julient31	a0e5d14990	Commit JT 040119 - corrected tangent vector projection - output verbose (Gradidottan)	2019-04-01 15:53:36 -06:00
julient31	3cabfd13cd	Commit JT 032619 - finish merge of min_spin.cpp - test output	2019-03-26 12:51:51 -06:00
julient31	676370ade7	Commit JT 032619 - added citeme in neb/spin - started work on distance output	2019-03-26 07:21:16 -06:00
julient31	c23ace9c97	Commit JT 032219 - fixed bug 1: precession_spin had no min_setup - fixed bug 2: incorrect init of spins in neb/spin - improved doc min_spin.txt (added eqs, and connected to related files).	2019-03-22 11:52:09 -06:00
julient31	2cbf56846a	Commit JT 032019 - moved gneb files from src/REPLICA to src/SPIN - changed name of min/spin - implemented read_param in min.cpp and min_spin.cpp - set sp_flag tests in min_spin.cpp and neb_spin.cpp	2019-03-20 10:41:36 -06:00

14 Commits