(Q52299018)

28 April 2018

title

Towards a potential-based conjugate gradient algorithm for order-N self-consistent total energy calculations. (English)

1 reference

28 April 2018

1

Gonze X

1 reference

PubMed ID

9986376

28 April 2018

language of work or name

English

0 references

publication date

1 August 1996

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28 April 2018

number of pages

4

1 reference

based on heuristic

inferred from page(s)

published in

Physical Review B

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28 April 2018

volume

54

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28 April 2018

page(s)

4383-4386

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28 April 2018

issue

7

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28 April 2018

Efficient linear scaling algorithm for tight-binding molecular dynamics.

cites work

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Direct calculation of electron density in density-functional theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Density-matrix electronic-structure method with linear system-size scaling.

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Orbital formulation for electronic-structure calculations with linear system-size scaling.

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Linear system-size scaling methods for electronic-structure calculations.

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

N-scaling algorithm for density-functional calculations of metals and insulators.

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Self-consistent first-principles technique with linear scaling

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Order-N multiple scattering approach to electronic structure calculations.

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Unified Approach for Molecular Dynamics and Density-Functional Theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Pseudopotential methods in condensed matter applications

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Iterative minimization techniques for ab initio total-energy calculations: molecular dynamics and conjugate gradients

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

Acceleration schemes for ab initio molecular-dynamics simulations and electronic-structure calculations.

21 January 2018

1 reference

https://api.crossref.org/works/10.1103%2FPHYSREVB.54.4383

21 January 2018

Identifiers

DOI

10.1103/PHYSREVB.54.4383

1 reference

28 April 2018

PubMed ID

9986376

1 reference

28 April 2018