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The Journal of Physical Chemistry. A|September 18, 2009
Examination of DFT and TDDFT methods IYi-Gui WangThe Journal of Physical Chemistry. A|September 18, 2009
Examination of DFT and TDDFT methods IIYi-Gui WangThe Journal of Physical Chemistry. A|October 27, 2017
Theoretical Studies of the Glycosidation of 2-O-Substituted 5-Fluorouracil: N-Regioselective Synthesis with the Phase-Transfer-Catalysis MethodYi-Gui Wang, Ericka C BarnesACS Omega|August 29, 2019
O-Regioselective Synthesis with the Silver Salt MethodYi-Gui Wang, Ericka C BarnesJournal of Computational Chemistry|April 30, 2004
Conformational energies for 2-substituted butanesKenneth B Wiberg, Yi-Gui WangJournal of Computational Chemistry|January 28, 2003
A practical and efficient method to calculate AIM localization and delocalization indices at post-HF levels of theoryYi-Gui Wang, Nick Henry WerstiukJournal of Computational Chemistry|September 10, 2003
Comparison of localization and delocalization indices obtained with Hartree-Fock and conventional correlated methods: effect of Coulomb correlationYi-Gui Wang, Cherif F Matta, Nick Henry WerstiukThe Journal of Physical Chemistry. A|April 20, 2007
Correlation effects in EOM-CCSD for the excited states: evaluated by AIM localization index (LI) and delocalization index (DI)Yi-Gui Wang, Kenneth B Wiberg, Nick H WerstiukJournal of Computational Chemistry|August 21, 2019
The Reactivity of Ambident Nucleophiles: Marcus Theory or Hard and Soft Acids and Bases Principle?Yi-Gui Wang, Ericka C Barnes, Savaș Kaya, et al.Chirality|July 2, 2013
Towards the accurate and efficient calculation of optical rotatory dispersion using augmented minimal basis setsKenneth B Wiberg, Marco Caricato, Yi-Gui Wang, et al.Pageof 2