S. B. Trickey

University of Florida — United States

Physics and Astronomy · Physical Sciences

45h-index10.4kcitations307works1.42yr avg
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Research Topics

Advanced Chemical Physics Studies(154), High-pressure geophysics and materials(48), Quantum, superfluid, helium dynamics(38), Spectroscopy and Quantum Chemical Studies(23), Machine Learning in Materials Science(23)

Publications307 total

Removing Orbital-Dependence to Improve Exchange-Correlation Functional Accuracy
The Journal of Physical Chemistry A·2025
Performance Improvement of Deorbitalized Exchange-Correlation Functionals
ArXiv.org·2025Open Access
Fully thermal meta-GGA exchange correlation free-energy density functional
Physical Review Materials·2025· 5 cited
Roadmap for warm dense matter physics
arXiv (Cornell University)·2025· 1 citedOpen Access
Travis E. Sjostrom [January 1, 1979–January 2, 2025]
Contributions to Plasma Physics·2025Open Access
Discovery of Spin-Crossover Materials with Equivariant Graph Neural Networks and Relevance-Based Classification
Journal of Chemical Theory and Computation·2025· 1 cited
Erratum: Deorbitalization strategies for meta-generalized-gradient-approximation exchange-correlation functionals [Phys. Rev. A <b>96</b>, 052512 (2017)]
Physical review. A/Physical review, A·2025· 2 cited
Free-energy orbital-free density functional theory: recent developments, perspective, and outlook
Electronic Structure·2025· 3 citedOpen Access
Discovery of Spin-Crossover Candidates with Equivariant Graph Neural Networks and Relevance-Based Classification
arXiv (Cornell University)·2025Open Access
Magnetic and Thermodynamic Computations for Supramolecular Assemblies between a Cr(III) and Fe(III) Single-Ion Magnet and an Fe(II) Spin-Crossover Complex
The Journal of Physical Chemistry A·2024· 2 cited
Effective Wang-Teter kernels for improved orbital-free density functional theory simulations
Physical review. B./Physical review. B·2024· 2 citedOpen Access
Quantum Theory, Quantum Materials, Quantum Computing
2024Open Access
Reworking the Tao–Mo Exchange–Correlation Functional. III. Improved Deorbitalization Strategy and Faithful Deorbitalization
The Journal of Physical Chemistry A·2024· 4 cited
Orbital-Free Quantum Simulation Methods for Application to Warm Dense Matter (Final Technical Report)
2024Open Access
Reworking the <i>Tao–Mo</i> exchange-correlation functional. I. Reconsideration and simplification
The Journal of Chemical Physics·2023· 6 cited
Reworking the Tao–Mo exchange–correlation functional. II. De-orbitalization
The Journal of Chemical Physics·2023· 5 cited
Orbital-Free Density Functional Theory: An Attractive Electronic Structure Method for Large-Scale First-Principles Simulations
Chemical Reviews·2023· 82 cited
Transition Temperature for Spin-Crossover Materials with the Mean Value Ensemble Hubbard-<i>U</i> Correction
The Journal of Physical Chemistry A·2023· 7 cited
All-electron APW+<i>lo</i> calculation of magnetic molecules with the SIRIUS domain-specific package
The Journal of Chemical Physics·2023· 2 citedOpen Access
Some problems in density functional theory
Letters in Mathematical Physics·2023· 9 citedOpen Access
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Frequent Co-authors

Valentin V. Karasiev(15), J. C. Boettger(9), Alberto Vela(6), James W. Dufty(4), John R. Sabin(4), Notker Rösch(4), Daniel Mejı́a-Rodrı́guez(4), Travis Sjostrom(3), E. D. Adams(3), José L. Gázquez(3), Peter Blaha(2), Karlheinz Schwarz(2), Andreas Görling(2), Lázaro Calderín(2), Debajit Chakraborty(2), Jorge M. del Campo(2), Kai Luo(2), Frank E. Harris(2), S. Peter Apell(2), P. Sorantin(1)