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Molecular dynamics in low-spin excited states

This folder holds the following references to publications, sorted by year and author.

There are 3 references in this bibliography folder.


Doltsinis, NL and Marx, D (2002).
Nonadiabatic Car-Parrinello Molecular Dynamics
Physical Review Letters, 88(16):166402.


Doltsinis, NL and Marz, D (2002).
First principle molecular dynamics involving excited states and nonadiabatic transitions
Journal of Theoretical and Computational Chemistry (JTCC), 1(2):319-349.


Frank, I, Hutter, J, Marx, D, and Parrinello, M (1998).
Molecular dynamics in low-spin excited states
The Journal of Chemical Physics, 108(10):4060–4069.

 
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