High-Precision Quantum Thermochemistry on Nonquasiharmonic...

High-Precision Quantum Thermochemistry on Nonquasiharmonic Potentials:  Converged Path-Integral Free Energies and a Systematically Convergent Family of Generalized Pitzer−Gwinn Approximations

Lynch, Vanessa Audette, Mielke, Steven L., Truhlar, Donald G.
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Volume:
110
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp061275p
Date:
May, 2006
File:
PDF, 42 KB
english, 2006
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