Pseudorotating Na 4 at finite temperatures: Tight-binding molecular dynamics studies

F. Wang; F. S. Zhang; Y. Abe

doi:10.1016/S0009-2614(00)00806-X

Pseudorotating Na ₄ at finite temperatures: Tight-binding molecular dynamics studies

F. Wang^*, F. S. Zhang, Y. Abe

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3 引用（Scopus）

摘要

We present the results of distance-dependent tight-binding molecular dynamics studies of Na₄ at finite temperatures, and especially discuss the pseudorotating pattern obtained at temperatures larger than 200 K. A pseudorotating barrier height of 0.023 eV is extracted.

源语言	英语
页（从-至）	461-467
页数	7
期刊	Chemical Physics Letters
卷	326
期	5-6
DOI	https://doi.org/10.1016/S0009-2614(00)00806-X
出版状态	已出版 - 25 8月 2000
已对外发布	是

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title = "Pseudorotating Na 4 at finite temperatures: Tight-binding molecular dynamics studies",

abstract = "We present the results of distance-dependent tight-binding molecular dynamics studies of Na4 at finite temperatures, and especially discuss the pseudorotating pattern obtained at temperatures larger than 200 K. A pseudorotating barrier height of 0.023 eV is extracted.",

author = "F. Wang and Zhang, {F. S.} and Y. Abe",

year = "2000",

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T1 - Pseudorotating Na 4 at finite temperatures

T2 - Tight-binding molecular dynamics studies

AU - Wang, F.

AU - Zhang, F. S.

AU - Abe, Y.

PY - 2000/8/25

Y1 - 2000/8/25

N2 - We present the results of distance-dependent tight-binding molecular dynamics studies of Na4 at finite temperatures, and especially discuss the pseudorotating pattern obtained at temperatures larger than 200 K. A pseudorotating barrier height of 0.023 eV is extracted.

AB - We present the results of distance-dependent tight-binding molecular dynamics studies of Na4 at finite temperatures, and especially discuss the pseudorotating pattern obtained at temperatures larger than 200 K. A pseudorotating barrier height of 0.023 eV is extracted.

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U2 - 10.1016/S0009-2614(00)00806-X

DO - 10.1016/S0009-2614(00)00806-X

M3 - Article

AN - SCOPUS:0042727392

SN - 0009-2614

VL - 326

SP - 461

EP - 467

JO - Chemical Physics Letters

JF - Chemical Physics Letters

IS - 5-6

ER -

Pseudorotating Na 4 at finite temperatures: Tight-binding molecular dynamics studies

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Pseudorotating Na ₄ at finite temperatures: Tight-binding molecular dynamics studies