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Journal of Computational Chemistry
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March 10, 2026
Extensions to Extended Tight-Binding Methods for Transition-Metal Containing Systems
Siyavash Moradi, Rebecca Tomann, Martin Head-Gordon, et al.
The Journal of Physical Chemistry Letters
|
October 15, 2024
Smooth Dispersion Is Physically Appropriate: Assessing and Amending the D4 Dispersion Model
Nikolay V Tkachenko, Linus Bjarne Dittmer, Rebecca Tomann, et al.
Journal of Computational Chemistry
|
August 23, 2024
Spin parameter optimization for spin-polarized extended tight-binding methods
Siyavash Moradi, Rebecca Tomann, Josie Hendrix, et al.
Chemical Science
|
November 21, 2025
Beyond real: alternative unitary cluster Jastrow models for molecular electronic structure calculations on near-term quantum computers
Nikolay V Tkachenko, Hang Ren, Wendy M Billings, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 4) with videos related to
Sort By:
Page
of 1
Journal of Computational Chemistry
|
March 10, 2026
Extensions to Extended Tight-Binding Methods for Transition-Metal Containing Systems
Siyavash Moradi, Rebecca Tomann, Martin Head-Gordon, et al.
The Journal of Physical Chemistry Letters
|
October 15, 2024
Smooth Dispersion Is Physically Appropriate: Assessing and Amending the D4 Dispersion Model
Nikolay V Tkachenko, Linus Bjarne Dittmer, Rebecca Tomann, et al.
Journal of Computational Chemistry
|
August 23, 2024
Spin parameter optimization for spin-polarized extended tight-binding methods
Siyavash Moradi, Rebecca Tomann, Josie Hendrix, et al.
Chemical Science
|
November 21, 2025
Beyond real: alternative unitary cluster Jastrow models for molecular electronic structure calculations on near-term quantum computers
Nikolay V Tkachenko, Hang Ren, Wendy M Billings, et al.
Page
of 1