Configuration State Functions

A presentation I gave to the Gagliardi Group on October 22, 2026, reproduced here (minus one slide that had originally contained copyrighted content), on the topic of configuration state functions for spin-adapted FCI calculations and their support in PySCF.

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Publication Details

Journal
Zenodo (CERN European Organization for Nuclear Research)
Published
2026-10-30
DOI
https://doi.org/10.5281/zenodo.23815261
Primary Topic
Advanced Chemical Physics Studies
Type
article
Field-Weighted Citation Impact
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article

Configuration State Functions

Matthew R. Hermes
Zenodo (CERN European Organization for Nuclear Research)
Advanced Chemical Physics Studies
article

Configuration State Functions

Matthew R. Hermes
article en

Abstract

A presentation I gave to the Gagliardi Group on October 22, 2026, reproduced here (minus one slide that had originally contained copyrighted content), on the topic of configuration state functions for spin-adapted FCI calculations and their support in PySCF.

Zenodo (CERN European Organization for Nuclear Research)
University of Chicago (US)
Openalex Percentile: Top 20%
Advanced Chemical Physics Studies
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Configuration State Functions — Matthew R. Hermes · Zenodo (CERN European Organization for Nuclear Research) (2026) | TGRS Research Map | TGRS