Theoretical study of the decomposition of formamide in the presence of water molecules

Journal of Physical Chemistry A

Volumn 117, Issue 12, 2013, Pages 2543-2555

  Nguyen, Vinh Son ^a   Orlando, Thomas M ^b   Leszczynski, Jerzy ^c   Nguyen, Minh Tho ^a  

^a UNIVERSITY OF LEUVEN   (Belgium)

^b GEORGIA INSTITUTE OF TECHNOLOGY   (United States)

^c JACKSON STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BI-FUNCTIONAL CATALYSTS; COMPLETE BASIS SET LIMIT; COUPLED-CLUSTER THEORY; PREBIOTIC CHEMISTRY; PRESENCE OF WATER; QUANTUM CHEMICAL COMPUTATIONS; RELATIVE ENERGIES; THEORETICAL STUDY;

AMIDES; DEHYDRATION; ENERGY BARRIERS; NUMERICAL METHODS; OLIGOMERS; QUANTUM CHEMISTRY;

MOLECULES;

AMMONIA; CARBON MONOXIDE; FORMAMIDE; FORMAMIDE DERIVATIVE; HYDROGEN CYANIDE; WATER;

ARTICLE; BIOGENESIS; CHEMICAL MODEL; CHEMISTRY; DESICCATION; QUANTUM THEORY; THERMODYNAMICS;

AMMONIA; BIOGENESIS; CARBON MONOXIDE; DESICCATION; FORMAMIDES; HYDROGEN CYANIDE; MODELS, CHEMICAL; QUANTUM THEORY; THERMODYNAMICS; WATER;

EID: 84875741312     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp312853j     Document Type: Article

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