Density-functional study of liquid methanol-Reference-Cited by-同舟云学术

Density-functional study of liquid methanol

Published:1999-09 Issue:3-4 Volume:311 Page:236-240
ISSN:0009-2614
Container-title:Chemical Physics Letters
language:en
Short-container-title:Chemical Physics Letters

Author:

Tsuchida Eiji,Kanada Yasumasa,Tsukada Masaru

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference31 articles.

1. Unified Approach for Molecular Dynamics and Density-Functional Theory

2. Iterative minimization techniques forab initiototal-energy calculations: molecular dynamics and conjugate gradients

3. Inhomogeneous Electron Gas

4. Self-Consistent Equations Including Exchange and Correlation Effects

5. See, e.g. E. Kaxiras, J. Joannopoulos, P. Vashishta, R.K. Kalia (Eds.), Materials Theory, Simulations, and Parallel Algorithms, Materials Research Society, 1996.

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