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A new all-round density functional based on spin states and SN2 barriers

American Institute of Physics

Manager: Ministerio de Educación y Ciencia (Espanya)
Date: 2018 June 1
Document access: http://hdl.handle.net/2072/311940
Publisher: American Institute of Physics
Rights: Tots els drets reservats
Subject: Enllaços d’hidrogen
Funcional de densitat, Teoria del
Pertorbació (Matemàtica)
Spin (Física nuclear)
Density functionals
Hydrogen bonding
Nuclear spin
Perturbation (Mathematics)
Title: A new all-round density functional based on spin states and SN2 barriers
Type: info:eu-repo/semantics/article
Repository: Recercat

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