Thermodynamic properties of PaCl5 and PaF5 based on quantum chemical calculations

Journal of Alloys and Compounds

Volumn 353, Issue 1-2, 2003, Pages 128-132

  Kovacs A ^a,b   Konings, R J M ^a   Nemcsok, D S ^b  

^a JOINT RESEARCH CENTRE   (Italy)

^b BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS   (Hungary)

Author keywords

Actinide compounds; Molecular geometry; Molecular vibrations; Quantum chemical computations; Thermodynamics

Indexed keywords

ENTHALPY; ENTROPY; MOLECULAR VIBRATIONS; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; THERMODYNAMICS;

DENSITY FUNCTIONAL THEORY (DFT);

PROTACTINIUM;

EID: 0037424863     PISSN: 09258388     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0925-8388(02)01200-8     Document Type: Article

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