Suggested Topics within your search.
Suggested Topics within your search.
Ab initio electronic structure methods
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Calculations
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Complete basis set limit
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Configuration-interaction calculations
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Electronic structure
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Electronic structure theory
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Excitation energy
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Excited states
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Incremental Strategy
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Medium-sized molecules
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Molecules
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Numerical methods
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Vertical excitation energy
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Wave function method
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Wave functions
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benchmark
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coupled cluster theory
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database
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excitation energies
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excited states
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full configuration interaction
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