Multistate, Polarizable QM/MM Embedding Scheme Based on the Direct Reaction Field Method: Solvatochromic Shifts, Analytical Gradients and Optimizations of Conical Intersections in Solution
Humeniuk, Alexander, Glover, William J.
Published in Journal of chemical theory and computation (12.03.2024)
Published in Journal of chemical theory and computation (12.03.2024)
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Journal Article
Does the Hydrated Electron Occupy a Cavity?
Larsen, Ross E, Glover, William J, Schwartz, Benjamin J
Published in Science (American Association for the Advancement of Science) (02.07.2010)
Published in Science (American Association for the Advancement of Science) (02.07.2010)
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Journal Article
Machine learning the Hohenberg-Kohn map for molecular excited states
Bai, Yuanming, Vogt-Maranto, Leslie, Tuckerman, Mark E, Glover, William J
Published in Nature communications (17.11.2022)
Published in Nature communications (17.11.2022)
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Journal Article
Ultrafast Photoisomerization of Ethylene Studied Using Time-Resolved Extreme Ultraviolet Photoelectron Spectroscopy
Karashima, Shutaro, Humeniuk, Alexander, Glover, William J., Suzuki, Toshinori
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (23.06.2022)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (23.06.2022)
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Journal Article
Prediction of Excited-State Properties of Oligoacene Crystals Using Fragment-Based Quantum Mechanical Method
Liu, Jinfeng, Sun, Haitao, Glover, William J, He, Xiao
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (05.07.2019)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (05.07.2019)
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Journal Article
Excited state non-adiabatic dynamics of the smallest polyene, trans 1,3-butadiene. II. Ab initio multiple spawning simulations
Glover, William J, Mori, Toshifumi, Schuurman, Michael S, Boguslavskiy, Andrey E, Schalk, Oliver, Stolow, Albert, Martínez, Todd J
Published in The Journal of chemical physics (28.04.2018)
Published in The Journal of chemical physics (28.04.2018)
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Journal Article
Short-Range Electron Correlation Stabilizes Noncavity Solvation of the Hydrated Electron
Glover, William J, Schwartz, Benjamin J
Published in Journal of chemical theory and computation (11.10.2016)
Published in Journal of chemical theory and computation (11.10.2016)
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Journal Article