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分类:导师信息 来源:武汉理工大学材料科学与工程学院 2019-08-27 相关院校:武汉理工大学
研究生导师简介
姓 名
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赵焱
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性 别
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男
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民 族
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男
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出生年月
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1971.12.5
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职 称
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教授
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职 务
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材料基因工程协同创新团队协同首席专家; 材料基因工程中心副主任
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联系电话
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单位名称
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武汉理工大学 硅酸盐建筑材料国家重点实验室
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Email
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yan2000@whut.edu.cn
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实验室网址
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暂无,学者主页http://www.researcherid.com/rid/A-2375-2008
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研究方向
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高精确度理论化学数据库的发展,新一代密度泛函的开发和应用,纳米材料的模拟,3D打印新技术开发,计算化学和3D打印软件开发,新能源存储与转换等
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教育背景
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1989-1993 复旦大学 材料化学本科
1993-1996 四川大学 工学硕士
1996-1999 四川大学 工学博士
2000-2005 美国明尼苏达大学 理学博士
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工作经历
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2005-2008 美国明尼苏达大学 海军科研项目主管
2009.1-2016.4 美国惠普中央研究院 (HP Labs)
研究员,高级研究员,首席研究员 2016.4-2017.7 美国应用材料公司 高级研究员兼产品研发经理
2017.7-现在 武汉理工大学 国家“XX计划”专家和湖北“百人计划”专家
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项目情况
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2017年国家“xx计划”创新长期项目(471-40122060)
2018年国家重点实验室基本科研业务费 (20131d0005)
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代表性学术
成果 |
以下仅列出引用次数≥500的学术论文
[1] Zhao Y, Truhlar D G. The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals[J]. Theoretical Chemistry Accounts, 2008, 120(1-3): 215-241.(Times Cited: 10545)
[2] Zhao Y, Truhlar D G. Density functionals with broad applicability in chemistry[J]. Accounts of chemical research, 2008, 41(2): 157-167.(Times Cited: 3713)
[3] Zhao Y, Truhlar D G. A new local density functional for main-group thermochemistry, transition metal bonding, thermochemical kinetics, and noncovalent interactions[J]. The Journal of chemical physics, 2006, 125(19): 194101.(Times Cited: 2234)
[4] Zhao Y, Schultz N E, Truhlar D G. Design of density functionals by combining the method of constraint satisfaction with parametrization for thermochemistry, thermochemical kinetics, and noncovalent interactions[J]. Journal of Chemical Theory and Computation, 2006, 2(2): 364-382.(Times Cited: 2188)
[5] Zhao Y, Truhlar D G. Hybrid meta density functional theory methods for thermochemistry, thermochemical kinetics, and noncovalent interactions: the MPW1B95 and MPWB1K models and comparative assessments for hydrogen bonding and van der Waals interactions[J]. The Journal of Physical Chemistry A, 2004, 108(33): 6908-6918.(Times Cited: 1217)
[6] Zhao Y, Truhlar D G. Design of density functionals that are broadly accurate for thermochemistry, thermochemical kinetics, and nonbonded interactions[J]. The Journal of Physical Chemistry A, 2005, 109(25): 5656-5667. (Times Cited: 780)
[7] Zhao Y, Truhlar D G. Density functional for spectroscopy: no long-range self-interaction error, good performance for Rydberg and charge-transfer states, and better performance on average than B3LYP for ground states[J]. The Journal of Physical Chemistry A, 2006, 110(49): 13126-13130. (Times Cited: 710)
[8] Zhao Y, Schultz N E, Truhlar D G. Exchange-correlation functional with broad accuracy for metallic and nonmetallic compounds, kinetics, and noncovalent interactions[J]. 2005.(Times Cited: 608)
[9] Zhao Y, González-García N, Truhlar D G. Benchmark database of barrier heights for heavy atom transfer, nucleophilic substitution, association, and unimolecular reactions and its use to test theoretical methods[J]. The Journal of Physical Chemistry A, 2005, 109(9): 2012-2018.(Times Cited: 556)
[10] Zhao Y, Lynch B J, Truhlar D G. Development and assessment of a new hybrid density functional model for thermochemical kinetics[J]. The Journal of Physical Chemistry A, 2004, 108(14): 2715-2719. (Times Cited: 531)
[11] Zhao Y, Truhlar D G. Exploring the limit of accuracy of the global hybrid meta density functional for main-group thermochemistry, kinetics, and noncovalent interactions[J]. Journal of Chemical Theory and Computation, 2008, 4(11): 1849-1868.(Times Cited: 500)
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……
更多信息详见http://smse.whut.edu.cn/yjspy/xsdw/sdxx/201906/t20190602_370652.htm
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