State-of-the-art ab initio potential energy curve for the krypton atom pair and thermophysical properties of dilute krypton gas

Journal of Chemical Physics

Volumn 144, Issue 11, 2016, Pages

  Jäger, Benjamin ^a   Hellmann, Robert ^a   Bich, Eckard ^a   Vogel, Eckhard ^a  

^a UNIVERSITY OF ROSTOCK   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; CLUSTER ANALYSIS; DIFFUSION IN LIQUIDS; KINETIC THEORY; KINETIC THEORY OF GASES; MOLECULAR PHYSICS; NUMERICAL METHODS; PERTURBATION TECHNIQUES; POTENTIAL ENERGY; QUANTUM CHEMISTRY; QUANTUM THEORY; STATISTICAL MECHANICS; THERMAL CONDUCTIVITY; THERMAL CONDUCTIVITY OF GASES; THERMODYNAMIC PROPERTIES; THERMODYNAMICS; UNCERTAINTY ANALYSIS; VISCOSITY;

AB INITIO POTENTIAL ENERGY CURVES; COMPLETE BASIS SET LIMIT; CORE-VALENCE CORRELATION EFFECTS; COUPLED-CLUSTER METHODS; PERTURBATIVE TRIPLE EXCITATIONS; QUANTUM-CHEMICAL METHODS; SELF-DIFFUSION COEFFICIENTS; THIRD VIRIAL COEFFICIENTS;

KRYPTON;

EID: 84961575297     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4943959     Document Type: Article

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