Tunneling splittings in water trimer by projector Monte Carlo
- 1 February 2000
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 112 (5) , 2218-2226
- https://doi.org/10.1063/1.480788
Abstract
No abstract availableKeywords
This publication has 34 references indexed in Scilit:
- Symmetry constraints and variational principles in diffusion quantum Monte Carlo calculations of excited-state energiesPhysical Review B, 1999
- Variational calculations of rovibrational energies of CH4 and isotopomers in full dimensionality using an ab initio potentialThe Journal of Chemical Physics, 1999
- Vibrational wave functions and energy levels of large anharmonic clusters: A vibrational SCF study of (Ar)13The Journal of Chemical Physics, 1996
- Vibrational frequency shift of HF in helium clusters: Quantum simulation and experimentThe Journal of Chemical Physics, 1996
- Anharmonic Wave Functions of Proteins: Quantum Self-Consistent Field Calculations of BPTIScience, 1995
- A diffusion Monte Carlo algorithm with very small time-step errorsThe Journal of Chemical Physics, 1993
- Quantum Monte Carlo studies of vibrational states in molecules and clustersPhysics Reports, 1991
- Quantum simulation of systems with nodal surfacesMolecular Physics, 1986
- Fixed-node quantum Monte Carlo for moleculesa) b)The Journal of Chemical Physics, 1982
- A random-walk simulation of the Schrödinger equation: H+3The Journal of Chemical Physics, 1975