On the treatment of singularities of the Watson Hamiltonian for nonlinear molecules

International Journal of Quantum Chemistry

Volumn 111, Issue 2, 2011, Pages 307-317

  Scivetti, Iván ^a   Kohanoff, Jorge ^a   Gidopoulos, Nikitas I ^b  

^a QUEEN'S UNIVERSITY BELFAST   (United Kingdom)

^b RUTHERFORD APPLETON LABORATORY   (United Kingdom)

Author keywords

floppy molecules; vibrational spectra; Watson Hamiltonian

Indexed keywords

FLOPPY MOLECULES; HIGHLY EXCITED STATE; JACOBIANS; LINEAR CONFIGURATION; NONLINEAR MOLECULES; NUCLEAR WAVE FUNCTIONS; NUMERICAL PROBLEMS; SINGULAR BEHAVIOR; SPURIOUS SOLUTIONS; VIBRATIONAL STATE; WATER MOLECULE; WATSON HAMILTONIAN;

BEHAVIORAL RESEARCH; HAMILTONIANS; LINEAR TRANSFORMATIONS; VIBRATIONAL SPECTRA;

MOLECULES;

EID: 78649696297     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.22732     Document Type: Article

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