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Quantum path interferences of electron trajectories in two-center molecules

โœ Scribed by Yang, Weifeng; Song, Xiaohong; Zeng, Zhinan; Li, Ruxin; Xu, Zhizhan


Book ID
115412736
Publisher
Optical Society of America
Year
2010
Tongue
English
Weight
278 KB
Volume
18
Category
Article
ISSN
1094-4087

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Two-electron integrations in the Quantum
โœ A. Martรญn Pendรกs; E. Francisco; M. A. Blanco ๐Ÿ“‚ Article ๐Ÿ“… 2005 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 119 KB

## Abstract A recent method proposed to compute twoโ€electron integrals over arbitrary regions of space [Martรญn Pendรกs, A. et al., J Chem Phys 2004, 120, 4581] is extended to deal with correlated wave functions. To that end, we use a monadic factorization of the secondโ€order reduced density matrix o