Dihua Wu

5PUBLICATIONS
94CO-AUTHORS
Programming languagesTheoretical quantum chemistryCondensed matter modelling and density functional theory
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Publications (5)

|May 22, 2023
The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry.

Giovanni Li Manni, Ignacio Fdez Galván, Ali Alavi

|Apr 20, 2023
New Gradient Correction Scheme for Electronically Nonadiabatic Dynamics Involving Multiple Spin States.

Yinan Shu, Linyao Zhang, Dihua Wu

|Mar 23, 2022
Zero-Field Splitting Calculations by Multiconfiguration Pair-Density Functional Theory.

Dihua Wu, Chen Zhou, Jie J Bao

|Jun 17, 2021
How Accurate Are Approximate Density Functionals for Noncovalent Interaction of Very Large Molecular Systems?

Dihua Wu, Donald G Truhlar

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