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★ ★ ★ ★ ★ cenwanglai(金币+5):呵呵,这个人对理论催化的来说,是很好的学习对象 2010-12-22 11:15:20
自己先来做个示范~
牛人姓名:Norskov.J.K
课题组网址:http://www.camd.dtu.dk/Jens_bog2_2007.aspx
研究方向:Research interests in the theoretical description of surfaces, catalysis, materials, nanostructures, and biomolecules.
代表作品:Chemical bonding at surfaces and interfaces
J.K. Norskov, F. Abild-Pedersen, Nature 461 (2009) 1223-1225.
推荐理由与评价: Approximately 340 published papers (cited 25 000 times, SCI April 2010, Hirsch index 85), 11 patents or patent applications
这位牛人目前从DTU跳槽到了Stanford,所以课题组网址失效了,我现在给的只是他在DTU的一些信息,不过大牛仍然是大牛
课题组网址:http://www.camd.dtu.dk/Jens_bog2_2007.aspx
研究方向:Research interests in the theoretical description of surfaces, catalysis, materials, nanostructures, and biomolecules.
代表作品:Chemical bonding at surfaces and interfaces
J.K. Norskov, F. Abild-Pedersen, Nature 461 (2009) 1223-1225.
推荐理由与评价: Approximately 340 published papers (cited 25 000 times, SCI April 2010, Hirsch index 85), 11 patents or patent applications
这位牛人目前从DTU跳槽到了Stanford,所以课题组网址失效了,我现在给的只是他在DTU的一些信息,不过大牛仍然是大牛
【老师姓名】(必填):戴瑛
【主页地址】:(必填)http://www.phym.sdu.edu.cn/staff/staff.php?id=27
【目前单位】(选填)山东大学物理学院
【发表文章】(选填)
2010年发表论文
Density Functional Theory Study of Ag Adsorption on SrTiO3 (001) Surface
Wei Wei; Ying Dai; Meng Guo; Yingtao Zhu; Baibiao Huang
J.Phys.Chem.C.2010
Codoping Synergistic Effects in N-doped SrTiO3 for High Energy Conversion Efficiency
Wei Wei, Ying Dai, Meng Guo, Lin Yu, Hao Jin, Shenghao Han, Baibiao Huang
Phys.chem.Chem.Phys. 2010.
【老师姓名】:马琰铭
【主页地址】:http://nlshm-lab.jlu.edu.cn/YanmingMa/mym.htm
【目前单位】:吉林大学超硬材料国家重点实验室
【发表文章】: 08 年以后的
2010:
112. Yu Xie, Artem R. Oganov, and Yanming Ma*(Corresponding author),“Novel high pressure structures and superconductivity of CaLi2”,Physical Review Letters in press (2010).
111. Dafang Li, Yanming Ma*(Corresponding author), and Jun Yan, “Comment on “Pressure-Dependent Metallic and Superconducting Phases in a Germanium Artificial Metal””Physical Review Letters 104, 139701 (2010).
【老师姓名】:崔田
【主页地址】:http://tcui.jlu.edu.cn/
【目前单位】:吉林大学超硬材料国家重点实验室
【发表文章】: 08 年以后的
2010
121. L. C. Wang, F. B. Tian, W. X. Feng, C. B. Chen, Z. He, Y. M. Ma, T. Cui,*(Corresponding author) B. B. Liu and G. T. Zou, " Order-disorder phase transition and dissociation of hydrogen sulfide under high pressure: ab initio molecular dynamics study", Journal of Chemical Physics in press.
120. C. B. Chen, F. B. Tian, L. C. Wang, D. F. Duan, T. Cui,*(Corresponding author) B. B. Liu and G. T. Zou, "New high-pressure phase of BaH2 predicted by ab initio studies", Journal of Physics-Condensed Matter in press.
【老师姓名】(必填):段文晖
【主页地址】:(必填)http://sparc.phys.tsinghua.edu.cn/duanwenhui.html
【目前单位】(选填)清华大学物理系
【发表文章】(选填)
已发表SCI收录论文100余篇,其中包括:
Physical Review Letters 7 篇;
Journal of the American Chemical Society 2 篇;
Nano Letters 1 篇;
PNAS(美国科学院院刊)1 篇;
Applied Physics Letters/Physical Review B/Journal of Chemical Physics 共50 多篇;
国际期刊综述论文2篇。
论文共被SCI引用800多次,其中他引600多次(“他引”指论文与引文没有任何共同作者)。
【老师姓名】(必填):孙强
【主页地址】:(必填)http://www.coe.pku.edu.cn/subpaget.asp?id=162
【目前单位】(选填)北京大学工学院先进材料与纳米技术系 教授
【发表文章】(选填)1). Electric Field Enhanced Hydrogen Storage on Polarizable Materials Substrates
PNAS, 2010.
(2) Ferromagnetism in semihydrogenated graphene sheet
Nano Lett. 9, 3867(2009).
(3) Potential of AlN Nanostructures as Hydrogen Storage Materials
ACS NANO 3, 621 (2009)
(4) Design of Janus nanoparticles with atomic precision: Tungsten-doped gold nanostructures
ACS NANO 2, 341 (2008)
【老师姓名】(必填):姚裕贵
【主页地址】:(必填)http://cqss.iphy.ac.cn/cv/YGYao.htm
【目前单位】(选填)中国科学院物理研究所量子模拟科学中心
【发表文章】(选填)1.Yugui Yao, et. al., “First principles calculation of anomalous Hall conductivity in ferromagnetic bcc Fe”, Phys. Rev. Lett. 92, 037204 (2004).
2. Yugui Yao, and Zhong Fang, “Sign Changes of Intrinsic Spin Hall Effect in Semiconductors and Simple Metals: First-principles Calculations”, Phys. Rev. Lett. 95, 156601 (2005).
3. Yugui Yao, Fei Ye, Xiao-Liang Qi, Shou-Cheng Zhang, and Zhong Fang, “Spin-orbit gap of graphene: First-principles calculations”, Phys. Rev. B (Rapid Commu.) 75, 041401(R) (2007).
4. Yugui Yao, Yongcheng Liang, Di Xiao, Qian Niu, Shun-Qing Shen, Xi Dai, and Zhong Fang, “Theoretical evidence of the Berry-phase mechanism in anomalous Hall transport: First-principles studies of CuCr2Se4?xBrx”, Phys. Rev. B (Rapid Commu.) 75, 020401(R) (2007).
【老师姓名】(必填):方忠
【主页地址】:(必填)http://cqss.iphy.ac.cn/cv/ZFang.htm
【目前单位】(选填)中国科学院物理研究所量子模拟科学中心
【发表文章】(选填)
【老师姓名】(必填):徐力方
【主页地址】:(必填)http://cqss.iphy.ac.cn/cv/LfXu.htm
【目前单位】(选填)中国科学院物理研究所量子模拟科学中心
【发表文章】(选填)H.X. Young, Y. Yu, L.F. Xu and C. Z. Gu,
"Ab initio Study of molecular adsorption on hydrogenated diamond (001) surfaces" J. of Physics: Conference Series 29, 145-149, (2006).
R. J. Xiao, H. X. Yang, L. F. Xu, H. R. Zhang, Y. G. Shi and J. Q. Li,
"Electronic structure and electron energy-loss spectra of Sr0.35CoO2",
Solid State Comm. 135, 687 (2005).
【老师姓名】(必填):戴 希
【主页地址】:(必填)http://cqss.iphy.ac.cn/cv/XDai.htm
【目前单位】(选填)中国科学院物理研究所量子模拟科学中心
【发表文章】(选填)X. Dai and F.C. Zhang,
"Light Induced Hall effect in semiconductors with spin-orbit coupling",
cond-mat/0605159, (2006).
Jian Li, Xi Dai, Shun-Qing Shen and Fu-Chun Zhang,
"Trans-verse electric current induced by optically injected spin current in cross-shaped InGaAs/InAlAs system",
APPLIED PHYSICS LETTERS 88,162105, (2006)
世界上做第一原理计算(方法)的几个牛组,从这些组出来的博士生、博士后、访问学者现在好多都在第一原理计算领域的开垦了自己的一小块田地。这些组不论是对推动方法的发展、应用等以及培养第一原理计算方法的新人都很突出的贡献。
1. The Cohen Research Group & The Louie Research Group
http://tiger.berkeley.edu/
2. Arthur Freeman
http://www.physics.northwestern. ... pages/afreeman.html
3. Ole Krogh Andersen
Theory group of Max-Planck-Institut für Festkörperforschung
http://www.fkf.mpg.de/en/fr_theory.html
4. Matthias Scheffler
http://www.fhi-berlin.mpg.de/th/ ... apper&Itemid=57
5. Theory of Condensed Matter group, Cavendish Laboratory in Cambridge
http://www.tcm.phy.cam.ac.uk/~mcp1/
6. The Condensed Matter Theory Sector of SISSA & CMSP Group of ICTP
http://www.sissa.it/cm/
http://portal.ictp.it/cmsp/
7. Center for Atomic-scale Materials Design, Technical University of Denmark
http://www.camd.dtu.dk/English.aspx
8. Kiyoyuki TERAKURA
http://staff.aist.go.jp/k-terakura/Eng3terakuraHP.htm
9. John Joannopoulos
http://ab-initio.mit.edu/people.html
10. Alex Zunger
http://www.nrel.gov/research_fellows/zunger.html
【老师姓名】:王彪
【主页地址】:http://spe.sysu.edu.cn/spe/wangbiao/Index.html
【目前单位】:中山大学物理科学与工程技术学院院长
【发表文章】: 08 年以后的
2009
1.
H. She, B. Wang, "Finite element analysis of conical, dome and truncated InAs quantum dots with consideration of surface effects," Semiconductor Science and Technology 24 (2), 4(2009).
2. X. Lu, B. Wang, Y. Zheng, and E. Ryba, "Phenomenological theory of 1-3 type multiferroic composite thin film: thickness effect," Journal of Physics D-Applied Physics 42 (1), 9(2009).
3. C. L. Li, B. Wang, Y. S. Li, and R. Wang, "First-principles study of electronic structure, mechanical and optical properties of V4AlC3," Journal of Physics D-Applied Physics 42 (6), 5 (2009).
【老师姓名】:刘兴军
【主页地址】:http://mse.xmu.edu.cn/faculty/lxj/lxj.htm
【目前单位】:厦门大学材料学院院长
【发表文章】: http://mse.xmu.edu.cn/faculty/lxj/lxj.htm
【老师姓名】:龚新高
【主页地址】:http://www.physics.fudan.edu.cn/tps/people/xggong/xggong.php
【目前单位】:复旦大学
【发表文章】:
ShiYou Chen,X.G. Gong,A. Walsh,S.H. Wei,Crystal and electronic band structure of Cu2ZnSnX4(X=S and Se)photovoltaic absorbers:First-principles insights,Applied Physics Letters,94(4):Art.No. 041903 Jan. 26 2009
Shiyou Chen,X.G. Gong,and Su-Huai Wei,Superhard pseudocubic BC2N superlattices,Physical Review Letters,98,015502(2007)
【老师姓名】:杨金龙
【主页地址】:http://staff.ustc.edu.cn/~jlyang/
【目前单位】:中国科学技术大学、合肥微尺度物质科学国家实验室
【发表文章】:http://staff.ustc.edu.cn/~jlyang/
【老师姓名】:王楠林
【主页地址】:http://sourcedb.cas.cn/sourcedb_ ... 090703_1911447.html
【目前单位】:中国科学院物理研究所
【发表文章】:王楠林研究员领导的EX1组早在上述26 K超导体发现之前就已经工作在Fe基超导系统。Hosono小组06年和07年关于LaOFeP和LaONiP超导电性的两篇文章分别发表在化学杂志,并不为超导领域研究工作者广泛所知,但受到陈根富副研究员的注意。2007年10月陈根富博士由德国回国加入王楠林领导的研究小组,他们讨论过这两篇文章之后决定生长晶体,以研究其物理性质。由于不希望与已经报道的组分完全相同,他们用同族的As取代P。2007年12月初陈根富开始LaOFeAs晶体生长。之后多次得到片状晶体,后来证实为FeAs,也得到部分LaAs,而不是期望的LaOFeAs。但这些工作的积累为后来的快速进展打下了基础。2008年2月下旬,当得知F-掺杂LaOFeAs多晶体在26K超导后,该小组的雒建林、陈根富等主要研究人员和全组研究力量都投入到新Fe基超导体材料合成和性质研究之中。他们立即改为合成多晶样品,并很快得到Tc超过20K的LaO0.9F0.1-xFeAs超导样品,之后迅速测量了新超导样品的物理性质,包括发现很高的上临界场,用红外光谱测定超导能隙大小,用Hall效应测量确立很低浓度的电子型载流子等。这是在日本小组的突破之后,在国际上开展的第一项物理研究工作。他们在3月2号向“Phys. Rev. Lett.”投稿该项工作,3月3号把该项工作张贴在物理学家广泛关注的arXiv.org网站,这也是该网站关于Fe基超导体的第一篇文章。该文章现已被“Phys. Rev. Lett.”接受发表(in-press),详细内容见arXiv:0803.0128。
之后该研究组对不同F含量的LaO1-xFxFeAs进行了系统研究,他们与物理所方忠课题组合作从比热、磁电阻、光电导谱测量和第一性原理计算首次提出LaOFaAs母体具有自旋密度波不稳定性,指出超导和自旋密度波不稳定性相互竞争,并预言了自旋密度波状态下的条纹反铁磁序磁结构。该项工作于3月24日张贴在arXiv:0803.3426,现已发表在“Europhys. Lett.”(83,27006,2008)。之后该研究组与美国戴鹏程小组合作进行中子衍射实验,证实了母体的反铁磁自旋密度波基态和理论预言的基态磁结构。另外发现电阻发生显著下降温度附近晶体结构具有微弱畸变,而长程磁有序在稍低温度形成。该文4月4日张贴在arXiv:0804.0795,已发表在“Nature”(453,899,2008)。
【老师姓名】:吕广宏
【主页地址】:http://compuphys.buaa.edu.cn/n208c67.aspx
【目前单位】:北京航空航天大学理学院物理系
【发表文章】:http://compuphys.buaa.edu.cn/c69.aspx
【老师姓名】:赵明文
【主页地址】:http://www.phym.sdu.edu.cn/staff/staff.php?id=48
【目前单位】:山东大学物理系
【发表文章】:
1. Covalent-adsorption induced magnetism in graphene, Weifeng Li, Mingwen Zhao*, Yueyuan Xia, Ruiqin Zhang and Yuguang Mu, J. Mater. Chem. 19, 9274 (2009).
2. Energetic Minimum Structures of Imogolite Nanotubes: A First-Principles Prediction, Mingwen Zhao*, Yueyuan Xia, Liangmo Mei, J. Phys. Chem. C 113, 14834 (2009).
【老师姓名】:赵宇军
【主页地址】:http://222.201.152.92/
【目前单位】:华南理工大学物理系
【发表文章】:49. "Comparison of S Poisoning Effects on Pd, Au, and Bimetallic PdAu(111) Surfaces" (abstract/pdf)
Li-Yong Gan, Yu-Xia Zhang, and Yu-Jun Zhao, J. Phys. Chem. C 114, 996(2010).
48. "The origin of p-type conduction in (P, N) co-doped ZnO" (abstract/pdf)
Ren-Yu Tian and Yu-Jun Zhao, J. Appl. Phys. 106, 043707(2009).
【老师姓名】:夏钶
【主页地址】:http://physics.bnu.edu.cn/application/faculty/xiake/index.htm
【目前单位】:北京师范大学物理学系
【发表文章】:
2009
R. Acharyya, H. Y. T. Nguyen, R. Loloee, W. P. Pratt, Jr., J. Bass, Shuai Wang,and Ke Xia, Specific resistance of Pd/Ir interfaces, APPLIED PHYSICS LETTERS 94, 022112(2009).
A. Sharma, N. Theodoropoulou, Shuai Wang, Ke Xia, W. P. Pratt, Jr., and J. Bass, Sensitivity of Ag/Al interface specific resistances to interfacial intermixing, JOURNAL OF APPLIED PHYSICS 106, ???(2009).
Youqi Ke, Ferdows Zahid, V. Timoshevskii, Ke Xia, D. Gall, and Hong Guo, Resistivity of thin Cu films with surface roughness, PHYSICAL REVIEW B 79, 155406(2009).
【老师姓名】:潘必才
【主页地址】:http://lixy.ustc.edu.cn/detail.p ... c1&postid=10708
【目前单位】:中国科技大学物理系
【发表文章】:
1. A.J. Lu, B. C. Pan*,
Nature of single vacancy in achiral carbon nanotubes,
Phys. Rev. Lett. (in press).
2. R. Biswas, B.C. Pan, Y.Y. Ye,
Metastability of amorphous silicon from silicon network rebonding,
Phys. Rev. Lett. 88, 205502(2002).
【老师姓名】:李微雪
【主页地址】:http://www.tc.dicp.ac.cn/members/wxli.htm
【目前单位】:中国科学院大连化学物理研究所
【发表文章】:
1) W.X. Li, Oxidation of platinum surfaces and reaction with carbon monoxide (Topical Review),
J. Phys.Condens. Matt. 20, 184002 (2008).
2) X. F. Ma, H. Q. Deng, M. M. Yang, and W. X. Li, Atomic and Molecular Adsorption on RhMn Alloy Surface: A First Principles Study, J. Chem. Phys. 129,244711 (2008)
3) X. Liu, S. B. Zhang, X. C. Ma, J. F. Jia, Q. K. Xue, X. H. Bao and W. X. Li, Wavevector-Dependent Quantum-Size Effect in Electron Decay Length at Pb Thin Film Surfaces, Appl. Phys. Lett., 93, 093105 (2008).
【老师姓名】:方海平
【主页地址】:http://www.sinap.ac.cn/physbio/zucheng/fhp.htm
【目前单位】:中科院上海应用物理研究所
【发表文章】:
1. Xiaojing Gong, Jingyuan Li, Hangjun Lu, Rongzheng Wan, Jichen Li, Jun Hu, and Haiping Fang*, A charge driven molecular water pump, NATURE Nanotechnology 2, 709-712 (2007) (Hightlighted in NATURE Nanotechnology “News & Views”、 “NATURE China”、 “New Scientist”)
2. Jingyuan Li, Xiaojing Gong, Hangjun Lu, Ding Li, Haiping Fang*, and Ruhong Zhou, Electrostatic Gating of a Nanometer Water Channel, Proc. Natl. Acad. Sci. USA 104,3687 (2007)
【老师姓名】(必填):Artem R. Oganov
【主页地址】:(必填)http://www.geosciences.stonybroo ... /oganov/oganov.html
【目前单位】(选填)Faculty member at Stony Brook since 2008
【发表文章】(选填)84. Oganov A.R. (2010). Boron under pressure: phase diagram and novel high-pressure phase.
In “Boron rich solids”, eds. N. Orlovskaya and M. Lugovy. In press.
我个人感觉能写code的小组里的主要人员也算是真正的牛人。
【老师姓名】(必填):Paolo Giannozzi
【主页地址】:(必填)http://www.fisica.uniud.it/~giannozz/
【目前单位】(选填)Dipartimento di Fisica, Università di Udine
【发表文章】(选填)
# Quantitative local environment characterization in amorphous oxides, A. Amézaga, Erik Holmström, R. Lizárraga, E. Menéndez-Proupin, P. Bartolo-Pérez, and P. Giannozzi, Phys. Rev. B 81, 014210 (2010).
# Gas adsorption on graphene doped with B, N, Al, S: a theoretical study, J. Dai, J. Yuan, and P. Giannozzi, Appl. Phys. Lett. 95, 232105 (2009).
# Ab initio theoretical investigation of Phthalocyanine-Semiconductor hybrid systems, G. Mattioli, F. Filippone, P. Giannozzi, R. Caminiti, and A. Amore Bonapasta, Chem. Mater. 21, 4555-4567 (2009)
【老师姓名】:李京波
【主页地址】:http://sourcedb.semi.cas.cn/zw/r ... 090730_2285714.html
【目前单位】:中国科学院半导体研究所
【代表性论著】
1) “Origin and enhancement of hole-induced ferromagnetism in first-row d0 semiconductors”, H. W. Peng, H. J. Xiang, S. H. Wei*, S. S. Li, J. B. Xia, and Jingbo Li*, Phys. Rev. Lett. 102, 017201 (2009).
2) “Design of narrow-gap TiO2 for enhanced photoelectrochecmical activity: A passivated codoping approach”, Y. Q. Gai, Jingbo Li*, S. S. Li, J. B. Xia, and S. H. Wei*, Phys. Rev. Lett. 102, 036402 (2009).
3) “Effect of Copassivation of Cl and Cu on CdTe Grain Boundaries”, L. X. Zhang, J. L. F Da Sliva, Jingbo Li, Y. Yan, T. A. Gessert, and S. H. Wei*, Phys. Rev. Lett. 101, 155501 (2008).
【老师姓名】曾雉
【主页地址】http://hf.cas.cn/sbpy/yjsb/zyhds ... 091204_2682207.html
【目前单位】中国科学院合肥固体物理研究所
【发表文章】H. Hao, X. H. Zheng, Z. X. Dai and Z. Zeng; Spin-filtering transport and switching effect of MnCu single-molecule magnet, Appl. Phys. Lett 96,192112 (2010)
G. R. Zhang, X. L. Zhang, T. Jia, Z. Zeng,and H. Q. Lin, Intrachain antiferromagnetic interaction and Mott state induced by spin-orbit coupling in Sr3NiIrO6 , JOURNAL OF APPLIED PHYSICS, 107, 09E120 (2010)
Meiyan Ni, Liangfeng Huang, L. J. Guo and Zhi Zeng, Hydrogen storage in Li-doped charged single-walled carbon nanotubes, Int. J. Hydrogen Energy 35, 3546 (2010)
【老师姓名】(必填):zi-kui Liu
【主页地址】:(必填)http://www.matse.psu.edu/fac/profiles/liu.htm
【目前单位】(选填)PHASES RESEARCH LAB OF PENNSTATE
【发表文章】(选填)
June 2, 2010
Carl Brubaker (MS, 2002) received the 2009-2010 Metallurgical Engineering Assistant's Award from the Philadelphia ASM chapter.
May 7, 2010
Guang Sheng received the 2009 Chinese Government Award for Outstanding Graduate Student Aboard.
May 4, 2010
Yi Wang’s Yphon paper is featured on the web site of Institute of Physics at http://iopscience.iop.org/0953-8984/labtalk-article/42532
【老师姓名】(必填):Chen Xiang-Rong
【主页地址】:(必填)http://jamp.scu.edu.cn/chenxiangrong/
【目前单位】(选填)四川大学
【发表文章】(选填)
Hong-Ling Cui, Guang-Fu Ji, Xiang-Rong Chen *, Qing-Ming Zhang, Dong-Qing Wei, Feng Zhao, Phase transitions and mechanical properties of octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine in different crystal phases by molecular dynamics simulation, J. Chem. Eng. Data, accepted
Cui-E Hu, Zhao-Yi Zeng, Lin Zhang, Xiang-Rong Chen, Ling-Cang Cai, Dario Alfè, Theoretical investigation of the high pressure structure, lattice dynamics, phase transition and thermal equation of state of titanium metal, J. Appl. Phys. 107 (2010) 093509
Cui-E Hu, Zhao-Yi Zeng, Lin Zhang, Xiang-Rong Chen *, Ling-Cang Cai, Phase transition and thermodynamics of thorium from first-principles calculations, Solid State Commun. 150 (2010) 293
绝对大牛,对DFT发展做了很多贡献,发展了超导体的密度泛函理论!
【老师姓名】E. K. U. Gross
【主页地址】http://users.physik.fu-berlin.de/~ag-gross/
【目前单位】Director at the Max Planck Institute of Microstructure Phsics, Halle.
【发表文章】http://users.physik.fu-berlin.de/~ag-gross/publications.html 发表文献的链接
先贴老前辈一代,现在已退休或快退休的老先生,他们为国内第一原理计算开创了天地并培样众多优秀的人才,他们的一些学生现在是国内这一领域的骨干。:
(通过web of science检索和追寻这一辈老先生在80年代初发的文章)
王鼎盛(中科院物理所), 在1980年初就在美国西北大学A. J. Freeman组进修。一直开展LAPW方法的工作以及磁性物理的计算。中科院院士。
http://hre.iphy.ac.cn/ability/rjcwds.asp
http://prb.aps.org/abstract/PRB/v24/i6/p3092_1
张开明 (复旦物理系),1980年就开始开展扩展休克的方法研究半导体表面。现已退休。比较简单的介绍的网页:
http://baike.baidu.com/view/320067.htm
http://avspublications.org/jvst/resource/1/jvstal/v17/i1/p506_s1
叶令 (复旦物理系).上个世纪80年代在A. J. Freeman组进修第一原理计算。现已退休。 简单的介绍:http://youa.baidu.com/item/2dabc5d843fd110bde18310f
http://avspublications.org/jvst/resource/1/jvstal/v17/i1/p506_s1
http://prl.aps.org/abstract/PRL/v53/i17/p1673_1
http://prb.aps.org/abstract/PRB/v39/i14/p10144_1
曹培林 (浙江大学物理系) 上个世纪80年代在A. J. Freeman组进修第一原理计算。现已退休。http://physics.zju.edu.cn/pw/phycaopl/fuye/caopeilinjianjie.htm
http://prb.aps.org/abstract/PRB/v25/i4/p2124_1
郑庆琪 (中科院合肥固体物理所)上个世纪80年代在A. J. Freeman组进行进修第一原理计算。现已退休。http://theory.issp.ac.cn/chenyuan/qingqi.htm
http://prb.aps.org/abstract/PRB/v30/i8/p4146_1
黄美纯(厦门大学物理系)上个世纪80年代在A. J. Freeman组进修第一原理计算。。现已退休。http://pmee.xmu.edu.cn/tech/huangmc.htm
http://prb.aps.org/abstract/PRB/v37/i7/p3489_1
(在A.J.Freeman组进修过的老前辈们回国后开展了LAPW方法的发展,特别是发展LMTO-ASA方法)
王崇愚(清华大学物理系) 中科院院士。http://sourcedb.cas.cn/sourcedb_ ... 090624_1808243.html
顾秉林(清华大学物理系) 中科院院士。在丹麦读博士期间,就开展了电子结构方面的工作。http://www.tsinghua.edu.cn/chn/xxjs/gbl.htm
王广厚(南京大学物理系) 团簇体系的第一原理计算。其专著《团簇物理学》。http://www.hudong.com/wiki/%E7%8E%8B%E5%B9%BF%E5%8E%9A
姚凯伦(华中科技大学物理系),早期工作基于模型哈密顿展开工作,2003年之后开始开展第一原理的计算工作。
http://prb.aps.org/abstract/PRB/v29/i7/p4071_1
【老师姓名】(必填):Artem R. Oganov
【主页地址】:(必填)http://mysbfiles.stonybrook.edu/~aoganov/
【目前单位】(选填)Dept. of Geosciences, Dept. of Physics and Astronomy, and New York Center for Computational Science, State University of New York at Stony Brook, Stony Brook NY 11794-2100, U.S.A
【发表文章】(选填);
Selected papers:
24. Xie Y., Oganov A.R., Ma Y. (2010). Novel structures and high pressure superconductivity of CaLi2. Phys. Rev. Lett. 104, 177005 (pdf-file, Supplementary Material).
23. Oganov A.R., Ma Y.M., Xu Y., Errea I., Bergara A., Lyakhov A.O. (2010). Exotic behavior and crystal structures of calcium under pressure. Proc. Natl. Acad. Sci.107, 1317-1320 (pdf-file, Supplementary Material).
22. Gao G., Oganov A.R., Li Z., Li P., Cui T., Bergara A., Lyakhov A.O., Ma Y., Iitaka T., Zou G. (2010). Crystal structures and superconductivity of stannane under high pressure. Proc. Natl. Acad. Sci. 107, 1317-1320 (pdf-file).
【老师姓名】(必填):Dario Alfè
【主页地址】:(必填)http://www.homepages.ucl.ac.uk/~ucfbdxa/
【目前单位】(选填)University College London ,
Gower Street, London, WC1E 6BT, UK.
【发表文章】(选填);108. D. Alfè and M.J. Gillan "Ab initio statistical mechanics of surface adsorption and desorption: II. Nuclear quantum effects", Journal of Chemical Physics, accepted.
107. D. Alfè, "Iron at Earth's Core Conditions from First Principles Calculations", Book Series: Reviews in Mineralogy & Geochemistry, 107,337-354 (2010).
【老师姓名】(必填):Paul von Ragué Schleyer
【主页地址】(必填)http://www.chem.uga.edu/schleyer/
【目前单位】(选填)University of Erlangen, University of Georgia, Athens
【发表文章】(选填) He has published over 1200 papers
【老师姓名】:陈冠华
【主页地址】:http://yangtze.hku.hk/new
【目前单位】:香港大学化学系
【发表文章】: http://yangtze.hku.hk/new/publication.php
113. "Time-dependent density functional theory for quantum transport", X. Zheng, G. H. Chen, Y. Mo, S. K. Koo, H. Tian, C. Y. Yam, and Y. J. Yan, J. Chem. Phys. 133, 114101 (2010).
112. "Computer simulation of Feynman’s ratchet and pawl system", J.Z. Zheng, X. Zheng, C.Y. Yam, G.H. Chen, Phys. Rev. E 81, 061104 (2010).
111. "Identification of influenza A nucleoprotein as an antiviral target", R.Y. Kao, D. Yang, L.S. Lau, W.H. W. Tsui, L.H. Hu, J. Dai, M.P. Chan, C. M. Chan, P. Wang, B.J. Zheng, J. Sun, J.D. Huang, J. Madar, G.H. Chen, H.L. Chen, Y. Guan and K.Y. Yuen, Nature Biotechnology 28, 600–605 (2010).
【老师姓名】:严以京
【主页地址】:http://ihome.ust.hk/~yyan/home.html
【目前单位】:香港科技大学化学系
【发表文章】:
【老师姓名】(必填):罗毅
【主页地址】:(必填)http://www.theochem.kth.se/people/luo/
【目前单位】(选填)中国科技大学, KTH(http://www.kth.se/)
【发表文章】(选填)
【老师姓名】(必填):Mark Ratner
【主页地址】:(必填)http://chemgroups.northwestern.edu/ratner
【目前单位】(选填)northwestern(USA)
【发表文章】(选填)2010
2010
The Chameleonic Nature of Electron Transport through pi-Stacked Systems, Solomon, GC; Herrmann, C; Vura-Weis, J; Wasielewski, MR; Ratner, MA, Journal of the American Chemical Society 2010 132 (23), 7887-+
Crossover from Single-Step Tunneling to Multistep Hopping for Molecular Triplet Energy Transfer, Vura-Weis, J; Abdelwahed, SH; Shukla, R; Rathore, R; Ratner, MA; Wasielewski, MR, Science 328 (5985), 1547-1550.
Electroluminescence spectra in weakly coupled single-molecule junctions, Seldenthuis, JS; van der Zant, HSJ; Ratner, MA; Thijssen, JM, Physical Review B 81 (20), 205430.
【老师姓名】(必填):Supriyo Datta
【主页地址】:(必填)http://cobweb.ecn.purdue.edu/~datta/
【目前单位】(选填)Purdue University
【发表文章】(选填)
再补充一个大牛。严以京教授的博士老师:Shaul Mukamel。
【老师姓名】(必填):Shaul Mukamel
【主页地址】(必填)http://mukamel.ps.uci.edu/
【目前单位】(选填) University of California
【发表文章】(选填)很多,见http://mukamel.ps.uci.edu/publications.html
Books
Principles of Nonlinear Optics and Spectroscopy. New York: Oxford University Press (1995).
Ultrafast Phenomena XII. Berlin: Springer (2000).
Stochasticity and Intramolecular Redistribution of Energy. Dordrecht: D. Reidel (1987).
Optical spectroscopy modeling package "SPECTRON".
【老师姓名】(必填)William A. Goddard, III
【主页地址】(必填)http://www.wag.caltech.edu/home/wag/index.htm
【目前单位】(选填)California Institute of Technology
【发表文章】(选填)发挂网上894篇了
http://www.wag.caltech.edu/publications/papers/
Charles and Mary Ferkel Professor of Chemistry, Materials Science, and Applied Physics
Director of Materials and Process Simulation Center (MSC)
世界化学排名好像二十几(包括实验)
[ Last edited by ellsaking on 2010-12-23 at 20:10 ] |
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