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• W3103173843 abstract "A nonempirical minimal atomic multipole expansion (MAME) defines atomic charges or higher multipoles that reproduce electrostatic potential outside molecules. MAME eliminates problems associated with redundancy and with statistical sampling, and produces atomic multipoles in line with chemical intuition." @default.
• W3103173843 created "2020-11-23" @default.
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• W3103173843 date "2004-01-13" @default.
• W3103173843 modified "2023-09-27" @default.
• W3103173843 title "Rules for minimal atomic multipole expansion of molecular fields" @default.
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• W3103173843 doi "https://doi.org/10.1063/1.1640995" @default.
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