Algorithms for Sampling a Quantum Microcanonical Ensemble...

Journal of Physical Chemistry A 2011 / 06 Vol. 115; Iss. 24

Algorithms for Sampling a Quantum Microcanonical Ensemble of Harmonic Oscillators at Potential Minima and Conical Intersections

Park, Kyoyeon, Engelkemier, Joshua, Persico, Maurizio, Manikandan, Paranjothy, Hase, William L.
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Volume:
115
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp110799m
Date:
June, 2011
File:
PDF, 2.49 MB
english, 2011
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