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MCTDH
mode combination
collocation

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2 results in Keywords: MCTDH, mode combination, collocation

Physical Chemistry

A Fragment Diabatization Linear Vibronic Coupling Model for Quantum Dynamics of Multichromophoric Systems: Population of the Charge Transfer State in the Photoexcited Guanine Cytosine Pair

James Green, Martha Yaghoubi Jouybari, Haritha Asha, Fabrizio Santoro, Roberto Improta

Version 1 posted 28 April 2021

306

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Theoretical and Computational Chemistry

Computing vibrational spectra using a new collocation method with a pruned basis and more points than basis functions: avoiding quadrature

Jesse Simmons, Tucker CARRINGTON

Version 3 posted 03 April 2023

145

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