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"Quick scheme for evaluation of atomic charges in arbitrary ..."
Alexander V. Larin, W. J. Mortier, Daniel P. Vercauteren (2007)
- Alexander V. Larin, W. J. Mortier, Daniel P. Vercauteren:
Quick scheme for evaluation of atomic charges in arbitrary aluminophosphate sieves on the basis of electron densities calculated with DFT methods. J. Comput. Chem. 28(10): 1695-1703 (2007)
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