Theoretical studies on VPI-5. 2. Energy decomposition analysis of the hydrophilicity

Journal of Physical Chemistry

Volumn 100, Issue 30, 1996, Pages 12424-12430

  Kitao, Osamu ^a,c   Gubbins, Keith E ^b  

^a KYOTO UNIVERSITY   (Japan)

^b School of Operations Research and Industrial Engineering   (United States)

^c NATL INST OF MAT AND CHEM RES   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ANALYSIS; CALCULATIONS; CHARGE TRANSFER; MOLECULAR DYNAMICS; PHYSICAL CHEMISTRY;

ALUMINOPHOSPHATES; CLUSTER MODELS; ENERGY DECOMPOSITION ANALYSIS; HYDROPHILICITY; INTERACTION ENERGIES; LEWIS ACIDS;

MOLECULAR SIEVES;

EID: 0030197345     PISSN: 00223654     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp952344v     Document Type: Article

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