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期刊论文 [47]
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Density functional theory calculations and thermodynamic analysis of bridgmanite surface structure
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2019, 卷号: 21, 期号: 3, 页码: 1009-1013
作者:
Geng, Ming
;
Jonsson, Hannes
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浏览/下载:28/0
  |  
提交时间:2019/03/04
High-pressure in-situ X-ray diffraction and Raman spectroscopy of Ca2AlFeO5 brownmillerite
期刊论文
HIGH PRESSURE RESEARCH, 2019, 卷号: 39, 期号: 1, 页码: 92—105
作者:
Li, ZM
;
Yin, Y
;
Rumney, JD
;
Shieh, SR
;
Xu, JG
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  |  
浏览/下载:22/0
  |  
提交时间:2019/12/30
EQUATION-OF-STATE
PHASE-TRANSITION
MGSIO3 PEROVSKITE
ALUMINUM
SUBSTITUTION
SERIES
IRON
COMPRESSIBILITY
MECHANISM
VACANCIES
Theoretical studies on the hydrous lower mantle and D″ layer minerals
期刊论文
Earth and Planetary Science Letters, 2019, 卷号: 525, 页码: 1-12
作者:
Jiajun Jiang;Feiwu Zhang
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浏览/下载:1/0
  |  
提交时间:2020/10/27
Hydrogen
bridgmanite
post-perovskite
phase Transition
elasticity Property
first-principal
Electronic and optical properties of Fe2SiO4 under pressure effect: ab initio study
期刊论文
EUROPEAN PHYSICAL JOURNAL B, 2018, 卷号: 91, 期号: 5, 页码: 7
作者:
Xiao, Lingping
;
Li, Xiaobin
;
Yang, Xue
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  |  
浏览/下载:10/0
  |  
提交时间:2019/08/23
Radiative conductivity and abundance of post-perovskite in the lowermost mantle
期刊论文
EARTH AND PLANETARY SCIENCE LETTERS, 2017, 卷号: 479, 期号: 无, 页码: 43-49
作者:
Lobanov, Sergey S.
;
Holtgrewe, Nicholas
;
Lin, Jung-Fu
;
Goncharov, Alexander F.
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  |  
浏览/下载:20/0
  |  
提交时间:2019/06/17
thermal conductivity
high pressure
optical spectroscopy
spin transition
core-mantle boundary
diamond anvil cell
Spinel and post-spinel phase assemblages in Zn2TiO4: an experimental and theoretical study
期刊论文
PHYSICS AND CHEMISTRY OF MINERALS, 2017
Zhang, Yanyao
;
Liu, Xi
;
Shieh, Sean R.
;
Bao, Xinjian
;
Xie, Tianqi
;
Wang, Fei
;
Zhang, Zhigang
;
Prescher, Clemens
;
Prakapenka, Vitali B.
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浏览/下载:45/0
  |  
提交时间:2017/12/03
Compressibility
DFT calculations
Diamond-anvil cell
High-P phase transition
Synchrotron X-ray diffraction
Zn2TiO4-CT
Zn2TiO4-Sp
EQUATION-OF-STATE
HIGH-PRESSURE PHASE
SYNTHETIC QANDILITE MG2TIO4
RAY-DIFFRACTION DATA
AMBIENT-TEMPERATURE
VOLUME MEASUREMENTS
MGSIO3 PEROVSKITE
SYSTEM ZNO-TIO2
MAGNESIUM-OXIDE
TRANSITION ZONE
Elasticity of single-crystal NAL phase at high pressure: A potential source of the seismic anisotropy in the lower mantle
期刊论文
JOURNAL OF GEOPHYSICAL RESEARCH-SOLID EARTH, 2016
Wu, Ye
;
Yang, Jing
;
Wu, Xiang
;
Song, Maoshuang
;
Yoshino, Takashi
;
Zhai, Shuangmeng
;
Qin, Shan
;
Huang, Haijun
;
Lin, Jung-Fu
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浏览/下载:6/0
  |  
提交时间:2017/12/03
NAL phase
single-crystal elasticity
seismic anisotropy
subducted slabs
lower mantle
SUBDUCTED BASALTIC CRUST
UPPERMOST LOWER MANTLE
DEEP MANTLE
BRILLOUIN-SCATTERING
MGSIO3 PEROVSKITE
OCEANIC-CRUST
CF PHASES
20 GPA
ZONE
TRANSITION
Gibbs Free Energy Minimization Computation Phase Boundary Between Ilmenite and Perovskite Structure of MgSiO3
会议论文
3rd International Conference on Advanced Composite Materials and Manufacturing Engineering (CMME), Beijing, PEOPLES R CHINA, MAY 30-31, 2015
作者:
Chen, Xiufang*
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浏览/下载:5/0
  |  
提交时间:2019/12/27
An adaptive genetic algorithm for crystal structure prediction
期刊论文
http://dx.doi.org/10.1088/0953-8984/26/3/035402, 2014
Wu, S. Q.
;
Ji, M.
;
Wang, C. Z.
;
Nguyen, M. C.
;
Zhao, X.
;
Umemoto, K.
;
Wentzcovitch, R. M.
;
Ho, K. M.
;
吴顺情
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  |  
浏览/下载:2/0
  |  
提交时间:2015/07/22
TOTAL-ENERGY CALCULATIONS
POST-PEROVSKITE PHASE
WAVE BASIS-SET
AB-INITIO DATA
EFFECTIVE POTENTIALS
HIGH-PRESSURE
MGSIO3
OPTIMIZATION
MGO
DISSOCIATION
New high-pressure polymorph of In2S3 with defect Th3P4-type structure
期刊论文
journal of solid state chemistry, 2014
Lai, Xiaojing
;
Zhu, Feng
;
Wu, Ye
;
Huang, Rong
;
Wu, Xiang
;
Zhang, Qian
;
Yang, Ke
;
Qin, Shan
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2015/11/10
In2S3
Pressure-induced phase transition
Th3P4-type structure
X-ray diffraction
POST-PEROVSKITE PHASE
CRYSTAL-STRUCTURE
TRANSITION
MGSIO3
MBAR
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