Theory and method for accelerating the convergence of self-consistent electronic structure calculations
Author:
Publisher
Elsevier BV
Subject
Computer Science Applications,Physics and Astronomy (miscellaneous),Applied Mathematics,Computational Mathematics,Modeling and Simulation,Numerical Analysis
Reference6 articles.
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5. General formulation of the variational cellular method for molecules and crystals
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3. Do You Have SCF Stability and Convergence Problems?;Computational Advances in Organic Chemistry: Molecular Structure and Reactivity;1991
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