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Committee Member: Levine, Benjamin G.
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Language: English
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Program of Study: *
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Subject: Mathematical models
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Collection
Electronic Theses & Dissertations
4
Material Type
Theses
4
Copyright Status
Creative Commons Licensed
1
In Copyright
3
Subject
Aromaticity (Chemistry)
1
Chemistry, Organic
1
Chemistry--Mathematics
1
Computer simulation
1
Hydrogen bonding
1
Metal ions
1
Nuclear magnetic resonance spectroscopy
1
Solvation
2
Wave functions
1
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I. amhb : (anti)aromaticity-modulated hydrogen bonding. ii. evaluation of implicit solvation models for predicting hydrogen bond free energies
Kakeshpour, Tayeb
Text (2019)
Part of
Electronic Theses & Dissertations
Advances in metal ion modeling
Li, Pengfei (Chemist)
Text (2016)
Part of
Electronic Theses & Dissertations
Merging active-space and renormalized coupled-cluster methods via the CC(P;Q) formalism, with applications to chemical reaction profiles and singlet-triplet gaps
Bauman, Nicholas P.
Text (2016)
Part of
Electronic Theses & Dissertations
A novel algorithm of solvation free energy calculation : the KECSA-movable type implicit solvation model (KMTISM)
Wang, Ting (M.S. in Chemistry)
Text (2015)
Part of
Electronic Theses & Dissertations
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