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 Date: 2009-05-20 07:41:47Path integral molecular dynamics Quantum Monte Carlo Quantum chemistry |
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| First Page | Document Content | |
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Date: 2009-05-20 07:41:47Path integral molecular dynamics Quantum Monte Carlo Quantum chemistry |
Add to Reading List |
THE JOURNAL OF CHEMICAL PHYSICS 130, 194510 共2009兲 On the applicability of centroid and ring polymer path integral molecular dynamics for vibrational spectroscopy Alexander Witt, Sergei D. Ivanov,a兲 Motoyuki Shiga