Ring-polymer molecular dynamics: Quantum effects in chemical dynamics from classical trajectories in an extended phase space

Annual Review of Physical Chemistry

Volumn 64, Issue , 2013, Pages 387-413

  Habershon, Scott ^a   Manolopoulos, David E ^b   Markland, Thomas E ^c   Miller III, Thomas F ^d  

^a UNIVERSITY OF WARWICK   (United Kingdom)

^b UNIVERSITY OF OXFORD   (United Kingdom)

^c STANFORD UNIVERSITY   (United States)

^d CALIFORNIA INSTITUTE OF TECHNOLOGY   (United States)

Author keywords

Path integral; Quantum dynamics; Semiclassical theory; Time correlation function; Tunneling; Zero point energy

Indexed keywords

PHASE SPACE METHODS; QUANTUM ELECTRONICS;

CONDENSED PHASE; CONDENSED PHASIS; PATH INTEGRAL; PHASE SPACES; QUANTUM DYNAMICS; RING-POLYMERS; SEMICLASSICAL THEORIES; TIME CORRELATION FUNCTIONS; TUNNELING; ZERO-POINT ENERGIES;

MOLECULAR DYNAMICS;

EID: 84874871042     PISSN: 0066426X     EISSN: None     Source Type: Book Series    
DOI: 10.1146/annurev-physchem-040412-110122     Document Type: Review

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