Structural, dynamic, electronic, and vibrational properties of flexible, intermediate, and stressed rigid As-Se glasses and liquids from first principles molecular dynamics

M. Bauchy, Ali Kachmar, M. Micoulaut

Research output: Contribution to journalArticle

18 Citations (Scopus)

Abstract

The structural, vibrational, electronic, and dynamic properties of amorphous and liquid AsxSe1-x (0.10

Original languageEnglish
Article number194506
JournalJournal of Chemical Physics
Volume141
Issue number19
DOIs
Publication statusPublished - 21 Nov 2014

Fingerprint

Structural dynamics
dynamic characteristics
Molecular dynamics
molecular dynamics
Glass
glass
Liquids
liquids
electronics

ASJC Scopus subject areas

  • Physics and Astronomy(all)
  • Physical and Theoretical Chemistry

Cite this

@article{4c31e6f41e0649ee885fa388306476c7,
title = "Structural, dynamic, electronic, and vibrational properties of flexible, intermediate, and stressed rigid As-Se glasses and liquids from first principles molecular dynamics",
abstract = "The structural, vibrational, electronic, and dynamic properties of amorphous and liquid AsxSe1-x (0.10",
author = "M. Bauchy and Ali Kachmar and M. Micoulaut",
year = "2014",
month = "11",
day = "21",
doi = "10.1063/1.4901515",
language = "English",
volume = "141",
journal = "Journal of Chemical Physics",
issn = "0021-9606",
publisher = "American Institute of Physics Publising LLC",
number = "19",

}

TY - JOUR

T1 - Structural, dynamic, electronic, and vibrational properties of flexible, intermediate, and stressed rigid As-Se glasses and liquids from first principles molecular dynamics

AU - Bauchy, M.

AU - Kachmar, Ali

AU - Micoulaut, M.

PY - 2014/11/21

Y1 - 2014/11/21

N2 - The structural, vibrational, electronic, and dynamic properties of amorphous and liquid AsxSe1-x (0.10

AB - The structural, vibrational, electronic, and dynamic properties of amorphous and liquid AsxSe1-x (0.10

UR - http://www.scopus.com/inward/record.url?scp=84911895996&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=84911895996&partnerID=8YFLogxK

U2 - 10.1063/1.4901515

DO - 10.1063/1.4901515

M3 - Article

VL - 141

JO - Journal of Chemical Physics

JF - Journal of Chemical Physics

SN - 0021-9606

IS - 19

M1 - 194506

ER -