Transition Temperature for Spin-Crossover Materials with the Mean Value Ensemble Hubbard-<i>U</i> Correction-Reference-Cited by-同舟云学术

Transition Temperature for Spin-Crossover Materials with the Mean Value Ensemble Hubbard-U Correction

Published:2023-09-05 Issue:36 Volume:127 Page:7646-7654
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Albavera-Mata Angel¹²^ORCID,Hennig Richard G.¹²^ORCID,Trickey S. B.¹³^ORCID

Affiliation:

1. Center for Molecular Magnetic Quantum Materials, Quantum Theory Project, University of Florida, Gainesville, Florida 32611, United States

2. Department of Materials Science and Engineering, University of Florida, 1885 Stadium Road, Gainesville, Florida 32611, United States

3. Department of Physics and Department of Chemistry, University of Florida, P.O. Box 118435, Gainesville, Florida 32611, United States

Funder

Energy Frontier Research Centers

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.3c03520

Reference106 articles.

1. Gütlich, P.; Goodwin, H. A. Spin Crossover in Transition Metal Compounds I; Springer: Berlin, Heidelberg, Germany, 2004; pp 1–47.

2. Kepp, K. P. In Transition Metals in Coordination Environments: Computational Chemistry and Catalysis Viewpoints; Broclawik, E., Borowski, T., Radoń, M., Eds. Springer International Publishing: Cham, Switzerland, 2019; pp 1–33.

3. McQuarrie, D. A. Statistical Mechanics; Harper and Row: New York, 1976; pp 35–64.

4. VII. On the production of transient electric currents in iron and steel conductors by twisting them when magnetised or by magnetising them when twisted

5. Spin crossover with thermal hysteresis: practicalities and lessons learnt

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