Accurate 57Fe Mössbauer Parameters from General Gaussian Basis Sets
Author:
Affiliation:
1. Institute of Computational Chemistry and Catalysis, Chemistry Department, University of Girona, Montilivi Campus, Girona, Catalonia 17003, Spain
Funder
Ministerio de Ciencia, Innovacion y Universidades
Ministerio de Educacion y Formacion Profesional
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.1c00722
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