Evaluation of Neel Temperatures from Fully Self-Consistent Broken-Symmetry GW and High-Temperature Expansion: Application to Cubic Transition-Metal Oxides-Reference-Cited by-同舟云学术

Evaluation of Neel Temperatures from Fully Self-Consistent Broken-Symmetry GW and High-Temperature Expansion: Application to Cubic Transition-Metal Oxides

Published:2023-06-16 Issue:25 Volume:14 Page:5777-5783
ISSN:1948-7185
Container-title:The Journal of Physical Chemistry Letters
language:en
Short-container-title:J. Phys. Chem. Lett.

Author:

Pokhilko Pavel¹^ORCID,Zgid Dominika¹²^ORCID

Affiliation:

1. Department of Chemistry, University of Michigan, Ann Arbor, Michigan 48109, United States

2. Department of Physics, University of Michigan, Ann Arbor, Michigan 48109, United States

Funder

Simons Foundation

Publisher

American Chemical Society (ACS)

Subject

General Materials Science,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpclett.3c00760

Reference64 articles.

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4. Computational quantum chemistry for single Heisenberg spin couplings made simple: Just one spin flip required

5. Computational Quantum Chemistry for Multiple-Site Heisenberg Spin Couplings Made Simple: Still Only One Spin–Flip Required

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