Augmented Roothaan-Hall Hessian Applied to Spin-Restricted Open-Shell Density Functional Theory

Yichi Zhang, Jun Yang

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DOI: 10.1021/acs.jctc.6c01383
Published: 2026-10-23
Container: Journal of Chemical Theory and Computation
Publisher: American Chemical Society (ACS)
Open access: unknown

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Cite this work

BibTeX

@article{allodium:10.1021/acs.jctc.6c01383,
  title = {Augmented Roothaan-Hall
Hessian Applied to Spin-Restricted
Open-Shell Density Functional Theory},
  author = {Yichi Zhang and Jun Yang},
  year = {2026},
  journal = {Journal of Chemical Theory
and Computation},
  doi = {10.1021/acs.jctc.6c01383},
  url = {https://doi.org/10.1021/acs.jctc.6c01383}
}

RIS

TY  - JOUR
TI  - Augmented Roothaan-Hall
Hessian Applied to Spin-Restricted
Open-Shell Density Functional Theory
AU  - Yichi Zhang
AU  - Jun Yang
PY  - 2026
JO  - Journal of Chemical Theory
and Computation
DO  - 10.1021/acs.jctc.6c01383
UR  - https://doi.org/10.1021/acs.jctc.6c01383
ER  -

APA

Zhang, Y., & Yang, J. (2026). Augmented Roothaan-Hall Hessian Applied to Spin-Restricted Open-Shell Density Functional Theory. Journal of Chemical Theory and Computation. https://doi.org/10.1021/acs.jctc.6c01383

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crossref · retrieved 2026-11-10T20:17:35.845Z