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The Journal of Chemical Physics|April 9, 2024
An experimental and computational view of the photoionization of diol-water clustersAnna Wannenmacher, Wenchao Lu, Chandika Amarasinghe, et al.Journal of Chemical Theory and Computation|June 1, 2022
Green's Function Formulation of Quantum Defect Embedding TheoryNan Sheng, Christian Vorwerk, Marco Govoni, et al.Proceedings of the National Academy of Sciences of the United States of America|November 9, 2021
Probing the electronic properties of the electrified silicon/water interface by combining simulations and experimentsZifan Ye, Aleksander Prominski, Bozhi Tian, et al.Physical Review Letters|November 13, 2003
Melting of lithium hydride under pressureTadashi Ogitsu, Eric Schwegler, François Gygi, et al.Journal of Chemical Theory and Computation|November 25, 2015
Structural and Vibrational Properties of Liquid Water from van der Waals Density FunctionalsCui Zhang, Jun Wu, Giulia Galli, et al.Journal of Chemical Theory and Computation|December 7, 2018
A Finite-Field Approach for GW Calculations beyond the Random Phase ApproximationHe Ma, Marco Govoni, Francois Gygi, et al.Proceedings of the National Academy of Sciences of the United States of America|September 24, 2008
Melting of ice under pressureEric Schwegler, Manu Sharma, François Gygi, et al.Social Cognitive and Affective Neuroscience|December 4, 2012
Emotion regulation modulates anticipatory brain activity that predicts emotional memory encoding in womenGiulia Galli, Victoria A Griffiths, Leun J OttenJournal of Chemical Theory and Computation|June 23, 2016
Implementation and Validation of Fully Relativistic GW Calculations: Spin-Orbit Coupling in Molecules, Nanocrystals, and SolidsPeter Scherpelz, Marco Govoni, Ikutaro Hamada, et al.Journal of Chemical Theory and Computation|February 15, 2023
Quantum Simulations of Fermionic Hamiltonians with Efficient Encoding and Ansatz SchemesBenchen Huang, Nan Sheng, Marco Govoni, et al.Pageof 57