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Journal of Chemical Theory and Computation|March 29, 2019
Describing Molecular Polarizability by a Bond Capacity ModelPier Paolo Poier, Frank JensenThe Journal of Chemical Physics|July 17, 2020
Polarizable charges in a generalized Born reaction potentialPier Paolo Poier, Frank JensenThe Journal of Chemical Physics|September 23, 2019
Including implicit solvation in the bond capacity polarization modelPier Paolo Poier, Frank JensenJournal of Chemical Theory and Computation|September 27, 2019
Molecular Dynamics Using Nonvariational Polarizable Force Fields: Theory, Periodic Boundary Conditions Implementation, and Application to the Bond Capacity ModelPier Paolo Poier, Louis Lagardère, Jean-Philip Piquemal, et al.The Journal of Chemical Physics|March 16, 2022
Variational formulation of the bond capacity charge polarization modelPier Paolo PoierJournal of Chemical Theory and Computation|February 8, 2022
Stochastic Evaluation of Many-Body van der Waals Energies in Large Complex SystemsPier Paolo Poier, Louis Lagardère, Jean-Philip PiquemalThe Journal of Chemical Physics|October 20, 2023
Smooth particle mesh Ewald-integrated stochastic Lanczos many-body dispersion algorithmPier Paolo Poier, Louis Lagardère, Jean-Philip PiquemalThe Journal of Physical Chemistry Letters|February 7, 2023
Generalized Many-Body Dispersion Correction through Random-Phase Approximation for Chemically Accurate Density Functional TheoryPier Paolo Poier, Olivier Adjoua, Louis Lagardère, et al.Journal of Chemical Theory and Computation|March 31, 2025
Calculating the Energy Profile of an Enzymatic Reaction on a Quantum ComputerPatrick Ettenhuber, Mads Bøttger Hansen, Pier Paolo Poier, et al.The Journal of Physical Chemistry Letters|May 11, 2022
Accurate Deep Learning-Aided Density-Free Strategy for Many-Body Dispersion-Corrected Density Functional TheoryPier Paolo Poier, Théo Jaffrelot Inizan, Olivier Adjoua, et al.Pageof 15