A fast path integral method for polarizable force fields.
A quantum simulation of an imaginary time path integral typically requires around n times more computational effort than the corresponding classical simulation, where n is the number of ring polymer beads (or imaginary time slices) used in the calculation. It is however possible to improve on this e...
Main Authors: | , , |
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Format: | Journal article |
Jezik: | English |
Izdano: |
2009
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