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"A constrained optimization algorithm for total energy minimization in ..."

Chao Yang, Juan C. Meza, Lin-Wang Wang (2006)

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DOI: 10.1016/J.JCP.2006.01.030

access: closed

type: Journal Article

metadata version: 2020-02-19

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Chao Yang, Juan C. Meza, Lin-Wang Wang:
A constrained optimization algorithm for total energy minimization in electronic structure calculations. J. Comput. Phys. 217(2): 709-721 (2006)

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