Thomas A Niehaus

3PUBLICATIONS
31CO-AUTHORS
Theoretical quantum chemistryComputational chemistryNumerical solution of differential and integral equations
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Publications (3)

|Jan 30, 2021
Excitonic and charge transfer interactions in tetracene stacked and T-shaped dimers.

Daniel C A Valente, Mariana T do Casal, Mario Barbatti

|Apr 04, 2020
DFTB+, a software package for efficient approximate density functional theory based atomistic simulations.

B Hourahine, B Aradi, V Blum

|Jan 03, 2019
An efficient approximate algorithm for nonadiabatic molecular dynamics.

Kota Hanasaki, Manabu Kanno, Thomas A Niehaus

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