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Theoretical and Computational Chemistry

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Robert Wodraszka

3 results in Authors: Robert Wodraszka

Theoretical and Computational Chemistry

A Collocation-Based Multi-Configuration Time-Dependent Hartree Method Using Mode Combination and Improved Relaxation

Robert Wodraszka, Tucker Carrington

Version 1 posted 27 February 2020

442

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Theoretical and Computational Chemistry

Efficiently transforming from values of a function on a sparse grid to basis coefficients

Tucker CARRINGTON, Robert Wodraszka

Version 1 posted 11 October 2021

128

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Theoretical and Computational Chemistry

Using a pruned basis and a sparse collocation grid with more points than basis functions to do efficient and accurate MCTDH calculations with general potential energy surfaces

Robert Wodraszka, Tucker Carrington

Version 1 posted 19 April 2024

80

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