Quantum Monte Carlo study of the classical barrier height for the H + H2 exchange reaction: Restricted versus unrestricted trial functions
- 1 March 1984
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 26 (S18) , 709-717
- https://doi.org/10.1002/qua.560260863
Abstract
No abstract availableKeywords
This publication has 30 references indexed in Scilit:
- Classical barrier height for H+H2→H2+HThe Journal of Chemical Physics, 1984
- The stochastic solution of the many-body Schroedinger equation for fermionsPublished by Springer Nature ,1981
- Quantum chemistry by random walk: Higher accuracyThe Journal of Chemical Physics, 1980
- H + H2: Potential‐Energy Surfaces and Elastic and Inelastic ScatteringAdvances in Chemical Physics, 1977
- History of H3 KineticsAnnual Review of Physical Chemistry, 1976
- Pseudonatural Orbitals as a Basis for the Superposition of Configurations. II. Energy Surface for Linear H3The Journal of Chemical Physics, 1968
- Molecular Schrödinger Equation. VI. Results for H3 and Other Simple SystemsThe Journal of Chemical Physics, 1967
- Monte Carlo Calculations of the Ground State of Three- and Four-Body NucleiPhysical Review B, 1962
- The Monte Carlo MethodJournal of the American Statistical Association, 1949
- I. Calculation of Energy of H3 MoleculeThe Journal of Chemical Physics, 1936