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Jessica A Martinez B

Showing results (1-10 of 6) with videos related to

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The Journal of Chemical Physics|November 15, 2023
Entropy is a good approximation to the electronic (static) correlation energyJessica A Martinez B, Xuecheng Shao, Kaili Jiang, et al.
Journal of Chemical Theory and Computation|December 12, 2025
Learning the One-Electron Reduced Density Matrix at SCF Convergence ThresholdsBhaskar Rana, Nicolas Viot, Jessica A Martinez B, et al.
The Journal of Physical Chemistry Letters|May 26, 2022
Role of Dielectric Screening in Calculating Excited States of Solvated Azobenzene: A Benchmark Study Comparing Quantum Embedding and Polarizable Continuum Model for Representing the SolventChandrima Chakravarty, Huseyin Aksu, Jessica A Martinez B, et al.
The Journal of Physical Chemistry. B|June 2, 2023
Which Physical Phenomena Determine the Ionization Potential of Liquid Water?Jessica A Martinez B, Lukas Paetow, Johannes Tölle, et al.
Journal of Chemical Theory and Computation|October 15, 2025
Density-Functionalized QM/MM Delivers Chemical Accuracy For Solvated SystemsXin Chen, Jessica A Martinez B, Xuecheng Shao, et al.
The Journal of Chemical Physics|April 30, 2024
Interoperable workflows by exchanging grid-based data between quantum-chemical program packagesKevin Focke, Matteo De Santis, Mario Wolter, et al.
Pageof 1

Showing results (1-10 of 6) with videos related to

Sort By:
Pageof 1
The Journal of Chemical Physics|November 15, 2023
Entropy is a good approximation to the electronic (static) correlation energyJessica A Martinez B, Xuecheng Shao, Kaili Jiang, et al.
Journal of Chemical Theory and Computation|December 12, 2025
Learning the One-Electron Reduced Density Matrix at SCF Convergence ThresholdsBhaskar Rana, Nicolas Viot, Jessica A Martinez B, et al.
The Journal of Physical Chemistry Letters|May 26, 2022
Role of Dielectric Screening in Calculating Excited States of Solvated Azobenzene: A Benchmark Study Comparing Quantum Embedding and Polarizable Continuum Model for Representing the SolventChandrima Chakravarty, Huseyin Aksu, Jessica A Martinez B, et al.
The Journal of Physical Chemistry. B|June 2, 2023
Which Physical Phenomena Determine the Ionization Potential of Liquid Water?Jessica A Martinez B, Lukas Paetow, Johannes Tölle, et al.
Journal of Chemical Theory and Computation|October 15, 2025
Density-Functionalized QM/MM Delivers Chemical Accuracy For Solvated SystemsXin Chen, Jessica A Martinez B, Xuecheng Shao, et al.
The Journal of Chemical Physics|April 30, 2024
Interoperable workflows by exchanging grid-based data between quantum-chemical program packagesKevin Focke, Matteo De Santis, Mario Wolter, et al.
Pageof 1