5 Commits

Author	SHA1	Message	Date
Sievers	903e33d86e	Added atom map into example, enforce atom map added to fix_numdiff, added error statement to fix_numdiff.h	2020-03-09 10:33:04 -06:00
Sievers	36ec95c2f5	fixed typo in numdiff example input	2020-03-05 09:55:25 -07:00
Sievers	968f44601c	Updated doc page with delta info and simplified example	2020-03-04 19:08:57 -07:00
Steve Plimpton	0723bf3db7	setup issues with fix numdiff	2020-03-02 13:32:05 -07:00
Sievers	13bff07606	Added documentation, added an example, avoided position round off, added in compute_pe's compute_scalar, now fix produces per-atom array instead of global array	2020-02-25 15:32:37 -07:00