High-temperature phase transition in TlN3

Jianjun Liu; Chun Gang Duan; M. M. Ossowski; W. N. Mei; R. W. Smith; J. R. Hardy

doi:10.1016/S0025-5408(01)00680-8

High-temperature phase transition in TlN₃

Jianjun Liu^*
, Chun Gang Duan
, M. M. Ossowski
, W. N. Mei
, R. W. Smith
, J. R. Hardy

^*此作品的通讯作者

University of Nebraska-Lincoln
University of Nebraska Omaha

科研成果: 期刊稿件 › 文章 › 同行评审

2 引用（Scopus）

摘要

The phase transition in TlN₃ is simulated based on the potentials calculated from the Gordon-Kim modified electron gas model extended to ion molecular crystals. It is found that TlN₃ transforms into a cubic CsCl structure at high temperature due to the rotations of the N₃ ions. Above the phase transition the orientations of the N₃^- ions are random with four preferred orientations with respect to the cubic axes.

源语言	英语
页（从-至）	2035-2041
页数	7
期刊	Materials Research Bulletin
卷	36
期	11
DOI	https://doi.org/10.1016/S0025-5408(01)00680-8
出版状态	已出版 - 15 9月 2001
已对外发布	是

访问文件

10.1016/S0025-5408(01)00680-8

其它文件与链接

链接到 Scopus 的出版物

引用此

@article{4999288865674676925ef4e883a24542,

title = "High-temperature phase transition in TlN3",

abstract = "The phase transition in TlN3 is simulated based on the potentials calculated from the Gordon-Kim modified electron gas model extended to ion molecular crystals. It is found that TlN3 transforms into a cubic CsCl structure at high temperature due to the rotations of the N3 ions. Above the phase transition the orientations of the N3- ions are random with four preferred orientations with respect to the cubic axes.",

keywords = "D. phase transitions",

author = "Jianjun Liu and Duan, \{Chun Gang\} and Ossowski, \{M. M.\} and Mei, \{W. N.\} and Smith, \{R. W.\} and Hardy, \{J. R.\}",

year = "2001",

month = sep,

day = "15",

doi = "10.1016/S0025-5408(01)00680-8",

language = "英语",

volume = "36",

pages = "2035--2041",

journal = "Materials Research Bulletin",

issn = "0025-5408",

publisher = "Elsevier Ltd",

number = "11",

}

TY - JOUR

T1 - High-temperature phase transition in TlN3

AU - Liu, Jianjun

AU - Duan, Chun Gang

AU - Ossowski, M. M.

AU - Mei, W. N.

AU - Smith, R. W.

AU - Hardy, J. R.

PY - 2001/9/15

Y1 - 2001/9/15

N2 - The phase transition in TlN3 is simulated based on the potentials calculated from the Gordon-Kim modified electron gas model extended to ion molecular crystals. It is found that TlN3 transforms into a cubic CsCl structure at high temperature due to the rotations of the N3 ions. Above the phase transition the orientations of the N3- ions are random with four preferred orientations with respect to the cubic axes.

AB - The phase transition in TlN3 is simulated based on the potentials calculated from the Gordon-Kim modified electron gas model extended to ion molecular crystals. It is found that TlN3 transforms into a cubic CsCl structure at high temperature due to the rotations of the N3 ions. Above the phase transition the orientations of the N3- ions are random with four preferred orientations with respect to the cubic axes.

KW - D. phase transitions

UR - https://www.scopus.com/pages/publications/0035885435

U2 - 10.1016/S0025-5408(01)00680-8

DO - 10.1016/S0025-5408(01)00680-8

M3 - 文章

AN - SCOPUS:0035885435

SN - 0025-5408

VL - 36

SP - 2035

EP - 2041

JO - Materials Research Bulletin

JF - Materials Research Bulletin

IS - 11

ER -

High-temperature phase transition in TlN3

摘要

访问文件

其它文件与链接

指纹

引用此

High-temperature phase transition in TlN₃