84 citations · 89 across the 4 of their papers we have counts for
4 papers
Advancing Quantum Many-Body GW Calculations on Exascale Supercomputing Platforms
Benran Zhang, Daniel Weinberg, Chih-En Hsu +9
Advanced ab initio materials simulations face growing challenges as increasing systems and phenomena complexity requires higher accuracy, driving up computational demands. Quantum…
Strong Electron Correlation from Partition Density Functional Theory
Yi Shi, Yuming Shi, Adam Wasserman
Standard approximations for the exchange-correlation (XC) functional in Kohn-Sham density functional theory (KS-DFT) typically lead to unacceptably large errors when applied to str…
Stretching bonds in Density Functional Theory without artificial symmetry breaking
Yuming Shi, Yi Shi, Adam Wasserman
Accurate first-principles calculations for the energies, charge distributions, and spin symmetries of many-electron systems are essential to understand and predict the electronic a…
Inverse Kohn-Sham Density Functional Theory: Progress and Challenges
Yuming Shi, Adam Wasserman
Inverse Kohn-Sham (iKS) problems are needed to fully understand the one-to-one mapping between densities and potentials on which Density Functional Theory is based. They are also i…