7 Commits

Author	SHA1	Message	Date
Axel Kohlmeyer	adf74b3a22	use https://lammps.sandia.gov based URLs consistently	2020-10-21 16:45:30 -04:00
Anne Gunn	f1ef7d85a8	T2345: Replace instances of NULL with nullptr ... The following changes have been applied to src and lib folders: regex replace: ([^"_])NULL ⇒ \1nullptr (8968 chgs in src, 1153 in lib) Manually find/change: (void \*) nullptr ⇒ nullptr (1 case) regex find: ".*?nullptr.*?" Manually ~14 cases back to "NULL" in src, ~2 in lib regex finds a few false positive where nullptr appears between two strings in a function call	2020-09-12 09:34:38 -06:00
Axel Kohlmeyer	88ddfa4eb0	more IWYU cleanup in packages	2020-09-03 05:20:02 -04:00
Axel Kohlmeyer	6113169a47	IWYU based include statement cleanup	2020-09-02 17:39:34 -04:00
Axel Kohlmeyer	96d8d12a88	replace calls to force->*numeric() with the corresponding utils::*numeric() ... this also removes the now obsolete functions from Force	2020-08-29 20:31:02 -04:00
Axel Kohlmeyer	fcd0b9f78f	move Force::bounds() and Force::boundsbig() to utils.	2020-08-29 18:23:03 -04:00
Evangelos Voyiatzis	5be0f1525a	source files for pair coul/slater ... Source files for long- and short-range coulombic interactions which are smeared with an exponential function (slater-type of smearing)	2020-02-26 14:02:53 +01:00