Benchmark Thermochemistry of the Hydroperoxyl Radical

Journal of Physical Chemistry A

Volumn 108, Issue 15, 2004, Pages 3195-3199

  Flowers, Bradley A ^a   Szalay, Péter G ^a,c   Stanton, John F ^a   Kállay, Mihály ^b   Gauss, Jürgen ^b   Császár, Attila G ^c  

^a The University of Texas at Austin   (United States)

^b JOHANNES GUTENBERG UNIVERSITY   (Germany)

^c EÖTVÖS LORÁND UNIVERSITY   (Hungary)

Author keywords

[No Author keywords available]

Indexed keywords

ANHARMONIC VIBRATIONAL ZERO POINT ENERGIES; BOND DISSOCIATION ENERGY (BDE); THERMOCHEMISTRY;

APPROXIMATION THEORY; CHEMICAL BONDS; COMPUTER SOFTWARE; ENTHALPY; IONIZATION; MOLECULAR VIBRATIONS; THERMAL EFFECTS;

FREE RADICALS;

EID: 2342483850     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp037347j     Document Type: Article

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50. -1 (OH).