A pictorial representation of zero-point energy and tunnelling contributions to primary hydrogen isotope effects

Journal of Physical Organic Chemistry

Volumn 23, Issue 7, 2010, Pages 572-579

  More O'Ferrall, R A ^a  

^a UNIVERSITY COLLEGE DUBLIN   (Ireland)

Author keywords

Hydrogen isotope effects; Tunnelling; Westheimer effect; Zero point energy

Indexed keywords

AMBIENT TEMPERATURES; FORCE CONSTANTS; HEAVY ATOMS; HYDROGEN ISOTOPE; HYDROGEN-TRANSFER REACTIONS; ISOTOPE EFFECT; MINIMUM ENERGY PATHS; PICTORIAL REPRESENTATION; PRODUCT CHANNEL; REACTION COORDINATES; STRETCHING MODES; STRETCHING VIBRATIONS; TRANSITION STATE; VIBRATIONAL MOTIONS; VIBRATIONAL WAVE FUNCTIONS; ZERO-POINT ENERGIES;

CARRIER MOBILITY; COMPLEXATION; HYDROGEN; ISOTOPES; POTENTIAL ENERGY; QUANTUM CHEMISTRY; SENSITIVITY ANALYSIS; STRETCHING; SURFACE REACTIONS;

HYDROGEN BONDS;

EID: 77955128138     PISSN: 08943230     EISSN: 10991395     Source Type: Journal    
DOI: 10.1002/poc.1738     Document Type: Review

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