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Two-dimensional ferromagnetism and driven ferroelectricity in van der Waals CuCrP2S6 期刊论文
NANOSCALE, 2019, 卷号: 11, 期号: 12, 页码: 5163-5170
Authors:  Lai, Youfang;  Song, Zhigang;  Wan, Yi;  Xue, Mingzhu;  Wang, Changsheng;  Ye, Yu;  Dai, Lun;  Zhang, Zhidong;  Yang, Wenyun;  Du, Honglin;  Yang, Jinbo
Favorite  |  View/Download:3/0  |  Submit date:2020/01/06
Wear Behaviors of GH4169 Super Alloy and 3Cr2W8V Tool Steel Under Dry Rolling Condition 期刊论文
ACTA METALLURGICA SINICA-ENGLISH LETTERS, 2018, 卷号: 31, 期号: 9, 页码: 983-996
Authors:  Bian, G;  Cheng, M;  Liu, Y;  Zhang, SH
Favorite  |  View/Download:3/0  |  Submit date:2018/12/25
Wear  Microhardness  Temperature  Strength-ductile combination  
Internal Polarization Modulation in Bi2MoO6 for Photocatalytic Performance Enhancement under Visible-Light Illumination 期刊论文
CHEMSUSCHEM, 2018, 卷号: 11, 期号: 9, 页码: 1521-1532
Authors:  Chen, Y;  Yang, WY;  Gao, S;  Zhu, LG;  Sun, CX;  Li, Q;  Li, Q (reprint author), Chinese Acad Sci, Environm Funct Mat Div, Shenyang Natl Lab Mat Sci, Inst Met Res, Shenyang 110016, Liaoning, Peoples R China.
Favorite  |  View/Download:29/0  |  Submit date:2018/06/05
Total-energy Calculations  Wave Basis-set  Heterogeneous Photocatalysis  Hydrothermal Synthesis  Controllable Synthesis  Carrier Separation  Electric-field  Water  Degradation  Tio2  
Atomic-scale observation and analysis of chemical ordering in M3B2 and M5B3 borides 期刊论文
ACTA MATERIALIA, 2018, 卷号: 149, 页码: 274-284
Authors:  Hu, XB;  Niu, HY;  Ma, XL;  Oganov, AR;  Fisher, CAJ;  Sheng, NC;  Liu, JD;  Jin, T;  Sun, XF;  Liu, JF;  Ikuhara, Y;  Ma, XL (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci, Shenyang 110016, Liaoning, Peoples R China.;  Ikuhara, Y (reprint author), Japan Fine Ceram Ctr, Nanostruct Res Lab, Nagoya, Aichi 4568587, Japan.;  Oganov, AR (reprint author), SUNY Stony Brook, Inst Adv Computat Sci, Ctr Mat By Design, Dept Geosci, Stony Brook, NY 11794 USA.
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Crystal-structure Prediction  Total-energy Calculations  Nickel-base Superalloys  Ni-based Superalloy  X-ray Spectroscopy  Wave Basis-set  Probe Tomography  Polycrystalline Superalloy  Grain-boundary  Resolution  
Insight into solid-solution strengthened bulk and stacking faults properties in Ti alloys: a comprehensive first-principles study 期刊论文
JOURNAL OF MATERIALS SCIENCE, 2018, 卷号: 53, 期号: 10, 页码: 7493-7505
Authors:  Wang, WY;  Zhang, Y;  Li, JS;  Zou, CX;  Tang, B;  Wang, H;  Lin, DY;  Wang, J;  Kou, HC;  Xu, DS;  Li, JS (reprint author), Northwestern Polytech Univ, State Key Lab Solidificat Proc, Xian 710072, Shaanxi, Peoples R China.
Favorite  |  View/Download:26/0  |  Submit date:2018/06/05
Beta-titanium Alloy  Total-energy Calculations  Close-packed Metals  Wave Basis-set  Deformation Mechanism  Electronic-structures  Phase-stability  Lattice Misfit  Alpha  Mg  
On the abnormal fast diffusion of solute atoms in alpha-Ti: A first-principles investigation 期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2018, 卷号: 740, 页码: 156-166
Authors:  Zhang, LJ;  Chen, ZY;  Hu, QM;  Yang, R;  Hu, QM (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci, 72 Wenhua Rd, Shenyang 110016, Liaoning, Peoples R China.
Favorite  |  View/Download:37/0  |  Submit date:2018/06/05
Grain-boundary Segregation  Austenitic Stainless-steel  Total-energy Calculations  Augmented-wave Method  Elastic Band Method  Alloying Elements  Self-diffusion  Impurity Diffusion  1st Principles  Saddle-points  
Direct Determination of Atomic Structure and Magnetic Coupling of Magnetite Twin Boundaries 期刊论文
ACS NANO, 2018, 卷号: 12, 期号: 3, 页码: 2662-2668
Authors:  Chen, CL;  Li, HP;  Seki, T;  Yin, DL;  Sanchez-Santolino, G;  Inoue, K;  Shibata, N;  Ikuhara, Y;  Chen, CL (reprint author), Chinese Acad Sci, Shenyang Natl Lab Mat Sci, Inst Met Res, Shenyang 110016, Liaoning, Peoples R China.;  Ikuhara, Y (reprint author), Tohoku Univ, Adv Inst Mat Res, Aoba Ku, 2-1-1 Katahira, Sendai, Miyagi 9808577, Japan.;  Ikuhara, Y (reprint author), Univ Tokyo, Inst Engn Innovat, Bunkyo Ku, 2-11-16 Yayoi, Tokyo 1138656, Japan.;  Ikuhara, Y (reprint author), Japan Fine Ceram Ctr, Nanostruct Res Lab, Atsuta Ku, 2-4-1 Mutsuno, Nagoya, Aichi 4568587, Japan.
Favorite  |  View/Download:20/0  |  Submit date:2018/06/05
Transmission Electron-microscopy  Differential Phase-contrast  Perovskite Manganite Films  Total-energy Calculations  Wave Basis-set  Resolution  Field  Anisotropy  Defects  
First-principles study of the atomic and electronic properties of (100) stacking faults in BaSnO3 crystal 期刊论文
CHEMICAL PHYSICS LETTERS, 2018, 卷号: 694, 页码: 65-69
Authors:  Xue, YB;  Wang, WY;  Guo, Y;  Guo, Y (reprint author), Anyang Inst Technol, Dept Chem & Environm Engn, Anyang 455000, Peoples R China.
Favorite  |  View/Download:21/0  |  Submit date:2018/06/05
Total-energy Calculations  Augmented-wave Method  Doped Basno3  Ab-initio  Barium Stannate  1st Principles  Thin-films  Basis-set  Perovskite  Ceramics  
Photoinduced reversible lattice expansion in W-doped TiO2 through the change of its electronic structure 期刊论文
APPLIED PHYSICS LETTERS, 2018, 卷号: 112, 期号: 6, 页码: -
Authors:  Feng, F;  Yang, WY;  Gao, S;  Zhu, LG;  Li, Q;  Li, Q (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci, Environm Funct Mat Div, Shenyang 110016, Liaoning, Peoples R China.
Favorite  |  View/Download:22/0  |  Submit date:2018/06/05
Total-energy Calculations  Effective Ionic-radii  Wave Basis-set  Nanotube Arrays  Actuators  Nitrogen  Photochromism  Performance  Oxidation  Dynamics  
Vacancy formation enthalpies of high-entropy FeCoCrNi alloy via first-principles calculations and possible implications to its superior radiation tolerance 期刊论文
JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2018, 卷号: 34, 期号: 2, 页码: 355-364
Authors:  Chen, WL;  Ding, XY;  Feng, YC;  Liu, XJ;  Liu, K;  Lu, ZP;  Li, DZ;  Li, YY;  Liu, CT;  Chen, XQ;  Chen, XQ (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci, Shenyang 110016, Liaoning, Peoples R China.
Favorite  |  View/Download:21/0  |  Submit date:2018/06/05
Total-energy Calculations  Solid-solution Alloys  Augmented-wave Method  Mechanical-properties  Single-phase  Multiprincipal Elements  Compressive Properties  Multicomponent Alloys  Wear-resistance  Basis-set