8 Commits

Author	SHA1	Message	Date
EnzoMonino	608547fc85	inputs and outputs H2	2021-02-26 17:59:00 +01:00
EnzoMonino	b3dc95c768	inputs and outputs CAM-B3LYP for H2	2021-02-23 13:27:26 +01:00
EnzoMonino	9d15de83e0	rename output	2021-01-22 16:55:53 +01:00
EnzoMonino	ea0478944a	H2 outputs	2021-01-21 18:12:22 +01:00
EnzoMonino	bc157d649b	H2 SF-BLYP results	2021-01-20 12:08:02 +01:00
EnzoMonino	05095381c5	H2 sf-td-b3lyp results	2021-01-20 08:44:17 +01:00
EnzoMonino	777e4c57c7	output	2021-01-06 16:05:07 +01:00
EnzoMonino	f1209227e7	rearrangement	2021-01-06 15:47:42 +01:00