2012年度出访情况

2012年度实验室成员受邀在各种国际国内会议中做邀请报告28次。

会议名称(时间、地点)

报告题目

报告人

Q-Chem Workshop

Beijing, 2011-11

Doubly hybrid functionals in Q-Chem: Towards chemical   accuracy for main group chemistry

徐昕

The Fifth Asian-Pacific Conference of Theoretical and   Computational Chemistry

NewZealand, 2011-12

Development of New Density Functionals for Accurate   Descriptions of Nonbond Interactions, Thermochemistry, and Thermochemical   Kinetics

徐昕

Computational Chemistry of the Norwegian Chemical   Society

Tromso,2012-6

Development of doubly hybrid functionals

徐昕

China-Japan-Korea Tripartite Workshop on Theoretical   and Computational Chemistry

Beijing,2012-7

Development of doubly hybrid functionals

徐昕

The 5th Cross-Strait Theoretical and Computational   Chemistry Conference (CTCC-5)

Xi’An, 2012-8

An extended ONIOM method for accurate geometry   optimization of zeolite

徐昕

Workshop on Computational Methods for Complex Systems

Hong Kong,2012-12

   An extended ONIOM (XO) method for large   systems

徐昕

24th   American Chemical Society National Meeting & Exhibition Symposium on Theory and Simulation in Energy and Fuel Production

Philadelphia,   2012-8

Si3AlP: a new   solar cell absorber

 

龚新高

18th  International Conference on Ternary and Multinary Compounds Salzburg,2012-8

 

Theoretical   understanding of the stability and defect properties of Cu2ZnSn(S,Se)4 alloys

龚新高

 

The 8th   Singapore-China Joint symposium on research frontiers in Physics.                Guangzhou, 2012-9

Theoretical   Understanding of Multinary Alloys for Solar Energy Absorber

龚新高

“Harnessing the Materials Genome:   Accelerated Materials Development via Computational

and Experimental Tools

Vail, Colorado, 2012-9

Si3AlP: a new   solar cell absorber. Harnessing the Materials Genome: Accelerated Materials Development via Computational and Experimental Tools.  

 

龚新高

International Symposium   on computics: Quantum Simulation and Design (ISC-QSD)

Osaka,2012-10

 

Computational Design of   Multinary Alloys for the Solar Absorbers.

龚新高

The 17th Conference on Condensed Matter Theory and   Statistical Physics in China

 Lanzhou, 2012-7

General Model for the   Spin-Order Induced Ferroelectric Polarization in Multiferroics

向红军

The 4th International Symposium on Structure-Property   Relationships in Solid State Materials

Bordeaux, 2012-6

General Model for the   Spin-Order Induced Ferroelectric Polarization in Multiferroics

向红军

The 4th   Asia Pacific Center for Theoretical Physics workshop on multiferroics,   Beijing, 2012-1

 

General theory for the   ferroelectric polarization induced by spin-spiral order

向红军

2012中国物理学会秋季会议

广州,2012-9

 

苯丙氨酸多肽纳米结构自组装机制研究

韦广红

第八届软物质与生命物质学术会议.

贵阳,2012-8

Computational   study of amyloid peptide-membrane interactions

韦广红

第一届世界华人计算生物和分子模拟大会

大连,   2012-8

Self-assembly   of amyloid and non-amyloid polypeptides

韦广红

CECAM workshop "Anchoring simulations to experiments: challenges   for understanding and treating Alzheimer's disease".   Paris,2012-5

Oligomerization   of Aβ(16-22) peptide and the effect of carbon nanotube on β-sheet formation

韦广红

第八届海峡两岸生物学启发的理论问题研讨会

湖北宜昌,2012-6

Probing   the self-assembly of Alzheimer's amyloid b-peptide fragments

韦广红

中国物理学会2012年秋季年会

广州,   2012-9

Spin-orbital   state driven metal-insulator transition

吴骅

IUPAC   World Polymer Congress-MACRO2012大会

美国,   2012-6

SCFT   study on phase behaviors of linear, star, and cyclic block copolymers

 

邱枫

大分子体系功能结构的理论模拟会议

南京,   2012-5

环型高分子的自组装

 

邱枫

日本北海道大学催化中心国际催化会议

日本,2012-1

固液界面电化学催化过程理论研究

刘智攀

国际理论化学研讨会 

以色列,2012-5

一种新的全局最小点寻找算法

刘智攀

国际电化学协会(ISE)春季会议

美国,2012-5

固液界面电化学催化过程理论研究

刘智攀

新加坡国际功能催化会议

新加坡,2012-8

固液界面电化学和光化学裂解水过程理论研究

刘智攀

16届全国催化学术会议

沈阳,2012.10

理论催化新进展:势能面搜索算法和固液界面催化过程研究

刘智攀