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浏览/检索结果: 共6条，第1-6条 帮助 已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 Structural phase transitions and superconductivity of YC2 from first-principles calculations 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 159, 页码: 120-126 作者:  Xue, Junling[1];  Guo, Yongliang[2];  Liu, Changdong[3];  Sun, Xinjun[4];  Qiu, Wujie[5] 收藏  |  浏览/下载：18/0  |  提交时间：2019/04/22 First-principles calculations  Crystal structure prediction  High-pressure phase transition  Superconductivity   First-principles study of the vibrational characteristics of the heavy element substitution on Cu3SbSe3 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 156, 页码: 167-174 作者:  Xue, Junling[1];  Zhang, Wenqing[2];  Xi, Lili[3];  Guo, Yongliang[4];  Sun, Xinjun[5] 收藏  |  浏览/下载：27/0  |  提交时间：2019/04/22 The lattice thermal conductivity (LTC)  Debye-Callaway model  Thermoelectric materials  First-principles calculations   Structure family and polymorphous phase transition in the compounds with soft sublattice: Cu2Se as an example 期刊论文 JOURNAL OF CHEMICAL PHYSICS, 2016, 卷号: 144, 页码: 194502 作者:  Qiu, Wujie[1];  Lu, Ping[2];  Yuan, Xun[3];  Xu, Fangfang[4];  Wu, Lihua[5] 收藏  |  浏览/下载：13/0  |  提交时间：2019/04/26 "Phonon" scattering beyond perturbation theory 期刊论文 SCIENCE CHINA-PHYSICS MECHANICS & ASTRONOMY, 2016, 卷号: 59, 页码: 1-8 作者:  Qiu, WuJie[1];  Ke, XueZhi[2];  Xi, LiLi[3];  Wu, LiHua[4];  Yang, Jiong[5] 收藏  |  浏览/下载：7/0  |  提交时间：2019/04/26 part-crystalline state  sublattice disorder  lattice thermal conductivity   Diverse lattice dynamics in ternary Cu-Sb-Se compounds 期刊论文 SCIENTIFIC REPORTS, 2015, 卷号: 5 作者:  Qiu, Wujie[1];  Wu, Lihua[2];  Ke, Xuezhi[3];  Yang, Jihui[4];  Zhang, Wenqing[5] 收藏  |  浏览/下载：2/0  |  提交时间：2019/04/30 Part-crystalline part-liquid state and rattling-like thermal damping in materials with chemical-bond hierarchy 期刊论文 PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 2014, 卷号: 111, 页码: 15031-15035 作者:  Qiu, Wujie[1];  Xi, Lili[2];  Wei, Ping[3];  Ke, Xuezhi[4];  Yang, Jihui[5] 收藏  |  浏览/下载：2/0  |  提交时间：2019/04/30 anharmonicity  first principles  partial Grüneisen parameter  sublattice melting