Title:	Design of Force Fields for Theoretical Spectroscopy
DNr:	SNIC 2019/3-365
Project Type:	SNIC Medium Compute
Principal Investigator:	Olav Vahtras <vahtras@kth.se>
Affiliation:	Kungliga Tekniska högskolan
Duration:	2019-06-27 – 2020-07-01
Classification:	10407
Keywords:

Abstract

This is a continuation application to 2015/1-230. It involves running a new version of the LoProp, previously interfaced with Dalton, now with VeloxChem our new HPC quantum chemistry code.