Projections of quantum observables onto classical degrees of freedom in mixed quantum-classical simulations: Understanding linear response failure for the photoexcited hydrated electron

Physical Review Letters

Volumn 97, Issue 13, 2006, Pages

  Bedard Hearn, Michael J ^a   Larsen, Ross E ^a   Schwartz, Benjamin J ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; DEGREES OF FREEDOM (MECHANICS); ELECTRONS; MOLECULAR DYNAMICS;

ENERGY RELAXATION; QUANTUM-MECHANICAL OBSERVABLES; THE LINEAR RESPONSE APPROXIMATION;

QUANTUM THEORY;

EID: 33749171427     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.97.130403     Document Type: Article

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