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List of works by Wei Wu

Ab initio valence bond theory: A brief history, recent developments, and near future

scientific article published on 01 September 2020

Attraction between electrophilic caps: A counterintuitive case of noncovalent interactions

scientific article published on 03 October 2018

Charge-Shift Bonding: A New and Unique Form of Bonding

scientific article published on 12 November 2019

Compact and accurate <i>ab initio</i> valence bond wave functions for electron transfer: The classic but challenging covalent-ionic interaction in LiF

scientific article published in 2022

Cross Conjugation in Polyenes and Related Hydrocarbons: What Can Be Learned from Valence Bond Theory about Single-Molecule Conductance?

scientific article published on 02 April 2019

Energy decomposition analysis based on broken symmetry unrestricted density functional theory

scientific article published on 01 December 2019

Extended Mulliken–Hush Method with Applications to the Theoretical Study of Electron Transfer

scientific article published on 04 October 2021

How Resonance Modulates Multiple Hydrogen Bonding in Self-Assembled Systems

scientific article published on 01 November 2019

Induction, Resonance and Secondary Electrostatic Interaction on Hydrogen Bonding in the Association of Amides and Imides

scientific article published on 16 October 2018

Novel implementation of seniority number truncated valence bond methods with applications to H22 chain

scientific article published on 01 November 2019

Performance of the VBSCF method for pericyclic and π bond shift reactions

scientific article published on 27 December 2018

Role of Intramolecular Electron Delocalization in the C-X Bond Strength in CH4-nX n ( n = 0-4, X = F, Cl, CN, OCH3)

scientific article published on 14 September 2018

Two-Dimensional Analysis of the Diabatic Transition of a General Vectorial Physical Observable Based on Adiabatic-to-Diabatic Transformation

scientific article published on 19 September 2019

Valence Bond Alternative Yielding Compact and Accurate Wave Functions for Challenging Excited States. Application to Ozone and Sulfur Dioxide

scientific article published on 15 December 2020

What kind of neutral halogen bonds can be modulated by solvent effects?

scientific article published on 11 October 2018

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