Evaluation of the quantum time-correlation functions employing the Hamilton–Jacobi dynamics framework
Author:
Funder
National Science Foundation
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry
Link
http://link.springer.com/article/10.1007/s00214-018-2398-6/fulltext.html
Reference58 articles.
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2. Hele TJH (2017) Thermal quantum time-correlation functions from classical-like dynamics. Mol Phys 115:1435–1462
3. Craig IR, Manolopoulos DE (2005) Chemical reaction rates from ring polymer molecular dynamics. J Chem Phys 122:084106
4. Cao J, Voth GA (1993) A new perspective on quantum time correlation functions. J Chem Phys 99:10070–10073
5. Miller WH (2001) The semiclassical initial value representation: a potentially practical way for adding quantum effects to classical molecular dynamics simulations. J Phys Chem A 105:2942–2955
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