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Xiaojing Wu
Xiaojing Wu
Université Paris-Saclay
Chemistry
Attosecond
Electron
Computational chemistry
Polarizability
5
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80
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AMOEBA Polarizable Force Field Parameters of the Heme Cofactor in its Ferrous and Ferric Forms
2018
Journal of Chemical Theory and Computation
Xiaojing Wu
Carine Clavaguéra
Louis Lagardère
Jean-Philip Piquemal
Aurélien de la Lande
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Citations (4)
Simulating Electron Dynamics in Polarizable Environments
2017
Journal of Chemical Theory and Computation
Xiaojing Wu
Jean-Marie Teuler
Fabien Cailliez
Carine Clavaguéra
Dennis R. Salahub
Aurélien de la Lande
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Citations (25)
Electronic Coupling Calculations for Bridge-Mediated Charge Transfer Using Constrained Density Functional Theory (CDFT) and Effective Hamiltonian Approaches at the Density Functional Theory (DFT) and Fragment-Orbital Density Functional Tight Binding (FODFTB) Level
2016
Journal of Chemical Theory and Computation
Natacha Gillet
Laura Berstis
Xiaojing Wu
Fruzsina Gajdos
Alexander Heck
Aurélien de la Lande
Jochen Blumberger
Marcus Elstner
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Citations (37)
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