Photoelectron spectra of FeS− explained by a CASPT2 ab initio study
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
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2. Deterministic Construction of Nodal Surfaces within Quantum Monte Carlo: The Case of FeS;Journal of Chemical Theory and Computation;2018-01-27
3. Multiconfiguration Pair-Density Functional Theory and Complete Active Space Second Order Perturbation Theory. Bond Dissociation Energies of FeC, NiC, FeS, NiS, FeSe, and NiSe;The Journal of Physical Chemistry A;2017-11-28
4. Photoelectron Spectroscopy and Density Functional Theory Studies of Iron Sulfur (FeS)m– (m = 2–8) Cluster Anions: Coexisting Multiple Spin States;The Journal of Physical Chemistry A;2017-09-26
5. Full Wave Function Optimization with Quantum Monte Carlo and Its Effect on the Dissociation Energy of FeS;The Journal of Physical Chemistry A;2017-08-07
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