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Determination of the shortest interatomic distance in a liquid metal using its structure factor. / Zhukova, L. a.; Afanas’eva, L. s.
In: Russian Metallurgy (Metally), Vol. 2007, No. 6, 01.12.2007, p. 473-477.

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Zhukova LA, Afanas’eva LS. Determination of the shortest interatomic distance in a liquid metal using its structure factor. Russian Metallurgy (Metally). 2007 Dec 1;2007(6):473-477. doi: 10.1134/S0036029507060067

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Zhukova, L. a. ; Afanas’eva, L. s. / Determination of the shortest interatomic distance in a liquid metal using its structure factor. In: Russian Metallurgy (Metally). 2007 ; Vol. 2007, No. 6. pp. 473-477.

BibTeX

@article{509bcbc4ca024e58a7aff0511dc577fb,
title = "Determination of the shortest interatomic distance in a liquid metal using its structure factor",
abstract = "The structure factor (SF) and atomic radial distribution function (RDF) of liquid lead simulated at a temperature of 613 K are compared. The shortest interatomic distance obtained from SF is found to be smaller than that determined as the abscissa of the first RDF coordination peak. It is shown that a satisfactory agreement between the experimental and calculated curves in the high-angle portion of SF can only be obtained when at least two most probable shortest interatomic distances r 1 and r 2, which indicate a complex structure of the first coordination shell of the liquid metal, are taken into account.",
author = "Zhukova, {L. a.} and Afanas{\textquoteright}eva, {L. s.}",
year = "2007",
month = dec,
day = "1",
doi = "10.1134/S0036029507060067",
language = "English",
volume = "2007",
pages = "473--477",
journal = "Russian Metallurgy (Metally)",
issn = "0036-0295",
publisher = "Pleiades Publishing",
number = "6",

}

RIS

TY - JOUR

T1 - Determination of the shortest interatomic distance in a liquid metal using its structure factor

AU - Zhukova, L. a.

AU - Afanas’eva, L. s.

PY - 2007/12/1

Y1 - 2007/12/1

N2 - The structure factor (SF) and atomic radial distribution function (RDF) of liquid lead simulated at a temperature of 613 K are compared. The shortest interatomic distance obtained from SF is found to be smaller than that determined as the abscissa of the first RDF coordination peak. It is shown that a satisfactory agreement between the experimental and calculated curves in the high-angle portion of SF can only be obtained when at least two most probable shortest interatomic distances r 1 and r 2, which indicate a complex structure of the first coordination shell of the liquid metal, are taken into account.

AB - The structure factor (SF) and atomic radial distribution function (RDF) of liquid lead simulated at a temperature of 613 K are compared. The shortest interatomic distance obtained from SF is found to be smaller than that determined as the abscissa of the first RDF coordination peak. It is shown that a satisfactory agreement between the experimental and calculated curves in the high-angle portion of SF can only be obtained when at least two most probable shortest interatomic distances r 1 and r 2, which indicate a complex structure of the first coordination shell of the liquid metal, are taken into account.

UR - http://www.scopus.com/inward/record.url?partnerID=8YFLogxK&scp=41549142221

U2 - 10.1134/S0036029507060067

DO - 10.1134/S0036029507060067

M3 - Article

VL - 2007

SP - 473

EP - 477

JO - Russian Metallurgy (Metally)

JF - Russian Metallurgy (Metally)

SN - 0036-0295

IS - 6

ER -

ID: 42248248