Ab initio potential energy surface and vibrational-rotational energy levels of X2Σ+

Journal of Physical Chemistry A

Volumn 106, Issue 41, 2002, Pages 9595-9599

  Koput, Jacek ^a   Peterson, Kirk A ^b  

^a ADAM MICKIEWICZ UNIVERSITY   (Poland)

^b WASHINGTON STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; GROUND STATE; HAMILTONIANS; HYDROGEN; LEAST SQUARES APPROXIMATIONS; MOLECULES; PERTURBATION TECHNIQUES; POLYNOMIALS;

CALCIUM MONOHYDROXIDE; HARMONIC OSCILLATOR FUNCTIONS; HIGHLY CORRELATED WAVE FUNCTIONS; INITIAL BASIS SET FUNCTIONS; ISOTOPOMERS; LEGENDRE FUNCTIONS; POTENTIAL ENERGY SURFACE; SPIN-RESTRICTED COUPLED-CLUSTER METHOD; VIBRATIONAL BASIS SET FUNCTIONS; VIBRATIONAL-ROTATIONAL ENERGY LEVELS;

CALCIUM COMPOUNDS;

EID: 0037126409     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp026283u     Document Type: Article

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