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searching for Ab initio quantum chemistry methods 4 found (34 total)

alternate case: ab initio quantum chemistry methods

Molecular fragmentation methods (603 words) [view diff] no match in snippet view article find links to article

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 (2,115 words) [view diff] exact match in snippet view article find links to article
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 (3,740 words) [view diff] exact match in snippet view article find links to article
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) [view diff] exact match in snippet view article find links to article
like Core. Her works in Analytical chemistry encompasses Ab initio quantum chemistry methods and Ambient pressure, while her Diffraction study integrates