A general procedure to obtain quantum mechanical charge and bond order molecular parameters (Q703962)

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A general procedure to obtain quantum mechanical charge and bond order molecular parameters
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    A general procedure to obtain quantum mechanical charge and bond order molecular parameters (English)
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    12 January 2005
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    Density analysis
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    Mulliken populations
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    atomic charges
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    bond orders
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    second order density
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    projection operators
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    expectation values
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