Investigation of the molecular rotation based on the minimization of the ro-vibrational Hamilton function

Proceedings of SPIE - The International Society for Optical Engineering

Volumn 3090, Issue , 1997, Pages 62-67

  Petrov, Sergei V ^a  

^a MOSCOW STATE UNIVERSITY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

MEATS; MOLECULAR DYNAMICS; MOLECULAR SPECTROSCOPY; PROBABILITY DENSITY FUNCTION; ROTATION; SPECTRUM ANALYSIS; STEREOCHEMISTRY;

ENERGY FUNCTIONS; ENERGY SURFACES; HAMILTON (CO); HAMILTONIAN;

FUNCTIONS;

EID: 0346744127     PISSN: 0277786X     EISSN: None     Source Type: Conference Proceeding    
DOI: 10.1117/12.267810     Document Type: Conference Paper

References (7)

1. W.G.Harter and C.W.Patterson, "Rotational energy surfaces and high-J eigenvalue structure of polyatomic molecules", J.Chem.Phys., v. 80, pp. 4241-4261, 1984
2. D.A.Sadovskii,B.I.Zhilinskii et al., "Manifestation of bifurcations and diabolic points in molecular energy spectra", J.Chem.Phys., v. 92, pp. 1523-1537, 1990
3. S.V.Petrov, "Rotational energy surface from the first principles", Proc. SPIE, v. 2205, pp. 173-177, 1994
4. S.V.Petrov, K.M.Katsov, "A priori effective rotational Hamiltonians. Rotational spectra of some simple molecular models", Chem.Phys.Lett., v. 246, pp. 649-653, 1995
5. I.M.Pavlichenkov and B.I.Zhilinskii, "Rotation of molecules around specific axes: axes reorientation under rotational excitation", Chem.Phys., v. 100, pp. 339-354, 1985
6. P.E.S.Wormer and J.Tennyson, J.Chem.Phys., v. 75, p. 1245, 1981
7. J.Tennyson and van der Avoird, J.Chem.Phys., v. 76, p. 5710, 1982