conftrace_

self-consistent field

2 papers

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Also known as

SCF

Co-occurring keywords · papers mentioning both

self-consistent field equation (1) nonlinear eigenvalue problem (1) wave function (1) online pca (1) numerical analysis (1) eigenvalue problem (1) density functional theory (1) non-stationary time series (1) deep learning (1) energy minimization (1)

Papers

D4FT: A Deep Learning Approach to Kohn-Sham Density Functional Theory ICLR 2023 Online PCA in Converging Self-consistent Field Equations NeurIPS 2023