S.B. Trickey
University of Florida
H-index: 47
North America-United States
Top articles of S.B. Trickey
Title | Journal | Author(s) | Publication Date |
|---|---|---|---|
Equivariant Graph Neural Networks for Predicting Spin-Crossover Energy in Transition Metal Complexes | Bulletin of the American Physical Society | Angel Albavera Mata Eric Fonseca Pawan Prakash Samuel Trickey Richard Hennig | 2024/3/5 |
Predictive, High-throughput Computation of Spin-Crossover | Bulletin of the American Physical Society | Samuel Trickey | 2024/3/5 |
Reworking the Tao–Mo exchange–correlation functional. II. De-orbitalization | The Journal of Chemical Physics | H Francisco AC Cancio SB Trickey | 2023/12/7 |
High-temperature self-energy corrections to x-ray absorption spectra | Physical Review B | Tun S Tan Joshua J Kas SB Trickey John J Rehr | 2023/3/10 |
Orbital-free density functional theory: An attractive electronic structure method for large-scale first-principles simulations | Wenhui Mi Kai Luo SB Trickey Michele Pavanello | 2023/10/23 | |
Ensemble Hubbard-U Correction for Improved Transition Temperatures for Spin-Crossover Materials | APS March Meeting Abstracts | Angel Albavera Mata Richard Hennig Samuel Trickey | 2023 |
Transition Temperature for Spin-Crossover Materials with the Mean Value Ensemble Hubbard-U Correction | The Journal of Physical Chemistry A | Angel Albavera-Mata Richard G Hennig SB Trickey | 2023/9/5 |
Deorbitalization of two-indicator-function meta-GGA exchange-correlation functionals | APS March Meeting Abstracts | Hector Francisco Rodriguez Samuel Trickey Antonio Cancio | 2023 |
All-electron APW+ lo calculation of magnetic molecules with the SIRIUS domain-specific package | The Journal of Chemical Physics | Long Zhang Anton Kozhevnikov Thomas Schulthess Samuel B Trickey Hai-Ping Cheng | 2023/6/21 |
Smoothing techniques to tame Laplacian-dependent exchange-correlation functionals | APS March Meeting Abstracts | Samuel Trickey Tun Sheng Tan Antonio Cancio | 2023 |
Some problems in density functional theory | Letters in Mathematical Physics | Jeffrey Wrighton Angel Albavera-Mata Héctor Francisco Rodríguez Tun S Tan Antonio C Cancio | 2023/4/8 |
Reworking the Tao–Mo exchange-correlation functional. I. Reconsideration and simplification | The Journal of Chemical Physics | H Francisco AC Cancio SB Trickey | 2023/12/7 |
DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science | Andrew M Teale Trygve Helgaker Andreas Savin Carlo Adamo Bálint Aradi | 2022 | |
Publisher’s Note:“Hardness of molecules and bandgap of solids from a generalized gradient approximation exchange energy functional”[J. Chem. Phys. 157, 114109 (2022)] | The Journal of Chemical Physics | Javier Carmona-Espíndola Anaid Flores José L Gázquez Alberto Vela SB Trickey | 2022/10/14 |
Minimization of Laplacian-level orbital-free exchange-correlation functionals | APS March Meeting Abstracts | Tun Sheng Tan Samuel Trickey | 2022 |
Hardness of molecules and bandgap of solids from a generalized gradient approximation exchange energy functional | The Journal of Chemical Physics | Javier Carmona-Espíndola Anaid Flores José L Gázquez Alberto Vela SB Trickey | 2022/9/21 |
Artifactual Liquid-Liquid Hydrogen Phase Transition from a Machine-Learnt Potential | APS March Meeting Abstracts | Samuel Trickey Valentin Karasiev Joshua Hinz Suxing Hu | 2022 |
Dipole Switching by Intramolecular Electron Transfer in Single-Molecule Magnetic Complex [Mn12O12(O2CR)16(H2O)4] | The Journal of Physical Chemistry A | Dmitry Skachkov Shuang-Long Liu Jia Chen George Christou Arthur F Hebard | 2022/8/8 |
Consistent deorbitalization and new deorbitalizers for meta-GGA exchange-correlation functionals | APS March Meeting Abstracts | Hector Francisco Rodriguez Samuel Trickey Antonio Cancio | 2022 |
Barriers to predictive high-throughput screening for spin-crossover | Computational Materials Science | Daniel Mejía-Rodríguez Angel Albavera-Mata Eric Fonseca Dian-Teng Chen HP Cheng | 2022/4/15 |
Co-Authors
