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searching for Ab initio quantum chemistry methods 4 found (34 total)
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Molecular fragmentation methods
(603 words)
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may be incomplete or very difficult to obtain. High-level ab-initio quantum chemistry methods are known to be an invaluable tool for understanding the
Mechanosynthesis
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like). All required reactions are analyzed using standard ab initio quantum chemistry methods. Further research to consider alternate tips will require
Molecular models of DNA
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can also be computed, at least in principle, by employing ab initio quantum chemistry methods that can attain high accuracy for small molecules, although
Natalia Dubrovinskaia
(2,616 words)
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like Core. Her works in Analytical chemistry encompasses Ab initio quantum chemistry methods and Ambient pressure, while her Diffraction study integrates