Stochastic simulation of long-time nonadiabatic dynamics

被引:10
|
作者
Uken, Daniel A. [1 ]
Sergi, Alessandro [1 ]
Petruccione, Francesco [2 ,3 ]
机构
[1] Univ KwaZulu Natal, Sch Phys, ZA-3209 Pietermaritzburg, South Africa
[2] Univ KwaZulu Natal, Sch Phys, ZA-4000 Durban, South Africa
[3] Univ KwaZulu Natal, Natl Inst Theoret Phys, ZA-4000 Durban, South Africa
关键词
QUANTUM-CLASSICAL DYNAMICS; SPIN-POLARIZED PLASMA; STATISTICAL-MECHANICS; LIOUVILLE DYNAMICS; MOLECULAR-DYNAMICS; SYSTEMS;
D O I
10.1088/0031-8949/2011/T143/014024
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Using a generalized transition probability, we show how nonadiabatic calculations, within the Wigner-Heisenberg representation of quantum mechanics, can be reliably extended to far longer times than those allowed by a primitive sampling scheme. Tackling the spin-boson model as a paradigmatic example, we provide substantial numerical evidence that the statistical error can be reduced for a wide range of parameter values.
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页数:6
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