Quantum Monte Carlo studies of vibrational states in molecules and clusters

Physics Reports

Volumn 204, Issue 4, 1991, Pages 293-329

  Suhm, Martin A ^a   Watts, Robert O ^b  

^a ETH ZURICH   (Switzerland)

^b UNIVERSITY OF WASHINGTON   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 13844314671     PISSN: 03701573     EISSN: None     Source Type: Journal    
DOI: 10.1016/0370-1573(91)90136-A     Document Type: Review

References (64)

1. Monte Carlo Calculations of the Ground State of Three- and Four-Body Nuclei
2. Quantum Monte Carlo study of the classical barrier height for the H + H2 exchange reaction: Restricted versus unrestricted trial functions
3. Quantum Monte Carlo calculation of the singlet–triplet splitting in methylene
4. Quantum simulation of systems with nodal surfaces
5. Quantum Monte Carlo for molecules: Green’s function and nodal release
6. The infrared predissociation spectra of water clusters
7. Potential energy surface and energy levels of (HF)2and its D isotopomers
8. The Vibrational Levels of an Anharmonic Oscillator
9. A local mode potential function for the water molecule
10. Finite field method calculations. VI. Raman scatering activities, infrared absorption intensities and higher-order moments: SCF and CI calculations for the isotopic derivatives of H2O and SCF calculations for CH4
11. The infrared absorption intensities of the water molecule: A quantum chemical study
12. Interpretation of infrared intensity changes on molecular complex formation. I. Water dimer
13. Electric dipole moments of low J states of H2O and D2O
14. Group theoretical classification of the tunneling–rotational energy levels of water dimer
15. The structure of water dimer from molecular beam electric resonance spectroscopy
16. Adiabatic separations of stretching and bending vibrations: Application to H2O
17. Anharmonic force constant calculations
18. Analytical potentials for triatomic molecules from spectroscopic data
19. The quantum mechanical Hamiltonian in curvilinear coordinates: A simple derivation
20. Considerations on the Rotation—Vibration of Triatomic Molecules
21. A variational method for the calculation of vibrational levels of any triatomic molecule
22. A variational method for the calculation of rovibrational levels of any triatomic molecule
23. An efficient procedure for the calculation of the vibrational energy levels of any triatomic molecule
24. A comment on a recent proposal for the calculation of vibrational energies in the general triatomic molecule