Yigui Wang
University of New Haven(US)
Publications by Year
Research Areas
Advanced Chemical Physics Studies, Molecular spectroscopy and chirality, Analytical Chemistry and Chromatography, Spectroscopy and Quantum Chemical Studies, Chemical Reaction Mechanisms
Most-Cited Works
- → Photothermal Conversion of CO2 with Tunable Selectivity Using Fe-Based Catalysts: From Oxide to Carbide(2020)182 cited
- → A practical and efficient method to calculate AIM localization and delocalization indices at post‐HF levels of theory(2003)74 cited
- → Comparison of localization and delocalization indices obtained with Hartree–Fock and conventional correlated methods: Effect of Coulomb correlation(2003)65 cited
- → Sum-over-States Calculation of the Specific Rotations of Some Substituted Oxiranes, Chloropropionitrile, Ethane, and Norbornenone(2006)61 cited
- → Conformational Effects on Optical Rotation. 2-Substituted Butanes(2005)59 cited
- → Optical Activity of 1-Butene, Butane, and Related Hydrocarbons(2003)57 cited
- → Incorporation of Cellulose Nanocrystals into Graphene Oxide Membranes for Efficient Antibiotic Removal at High Nutrient Recovery(2021)55 cited
- → Optical Rotatory Dispersion of 2,3-Hexadiene and 2,3-Pentadiene(2008)46 cited
- → Comparison of CIS- and EOM-CCSD-Calculated Adiabatic Excited-State Structures. Changes in Charge Density on Going to Adiabatic Excited States(2004)39 cited
- → Correlation Effects in EOM-CCSD for the Excited States: Evaluated by AIM Localization Index (LI) and Delocalization Index (DI)(2007)38 cited