On the Convergence of the Self-Consistent Field Iteration in Kohn-Sham Density Functional Theory.
Xin LiuXiao WangZaiwen WenYa-Xiang YuanPublished in: SIAM J. Matrix Anal. Appl. (2014)
Keyphrases
- iterative algorithms
- theoretical framework
- neural network
- computational intelligence
- theoretical basis
- iterative process
- knowledge base
- decision trees
- bayesian networks
- evolutionary algorithm
- genetic algorithm
- convergence rate
- decision theory
- databases
- functional properties
- functional analysis
- number of iterations required