Fully coupled six-dimensional calculations of the water dimer vibration-rotation-tunneling states...

来自 EBSCO

阅读量:

15

作者:

LeforestierClaudeBralyLindaB.KunLiuElrodMatthewJ.

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摘要:

Presents a novel and efficient pseudospectral method for performing fully coupled six-dimensional bound state dynamics calculations. Rotational effects; Lanczos-based iterative diagonalization scheme's production of energy levels in increasing energies; Circumvention of constructing the full matrix; Quantum Monte Carlo dynamic methods.

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被引量:

50

年份:

1997

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