(Q57963654)

English

Optimal basis set for electronic structure calculations in periodic systems

scholarly article in Physical Review B, vol. 62 no. 23, December 2000

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scholarly article

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Optimal basis set for electronic structure calculations in periodic systems (English)

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Jorge Kohanoff

2

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author name string

Sandro Scandolo

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1

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English

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publication date

15 December 2000

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Physical Review B

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volume

62

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issue

23

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page(s)

15499-15504

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Unified Approach for Molecular Dynamics and Density-Functional Theory

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21 January 2018

Special points for Brillouin-zone integrations

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21 January 2018

Solid Molecular Hydrogen: The Broken Symmetry Phase

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21 January 2018

Dipole-Quadrupole Interactions and the Nature of Phase III of Compressed Hydrogen

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Self-Consistent Equations Including Exchange and Correlation Effects

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Chemically Motivated Pseudopotential for Sodium

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Ground State of the Electron Gas by a Stochastic Method

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21 January 2018

Statistical properties of the dense hydrogen plasma: Anabinitiomolecular dynamics investigation

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Insulator-metal transition in solid hydrogen: Implication of electronic-structure calculations for recent experiments

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21 January 2018

Cohesion in aluminum systems: A first-principles assessment of "glue" schemes

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Quantum-mechanical theory of stress and force

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Identifiers

DOI

10.1103/PHYSREVB.62.15499

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arXiv ID

cond-mat/0008383

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(Q57963654)

Optimal basis set for electronic structure calculations in periodic systems

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