1

The 16th Asian Workshop on First-Principles   Electronic Structure Calculations
  Beijing, 2013 Oct.

Unified Model for the Spin-Order Induced   Polarization in Multiferroics

向红军

2

12th International Conference on Condensed   MatterTheory and Computational Materials Science
  Guangzhou, 2013 Aug.

Unified model for spin order induced polarization in   multiferroics

向红军

3

16th International Workshop on Computational Physics   and Materials Science: Total Energy and Force Methods
  Trieste, 2013 Jan. .

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

向红军

4

APCAT-6 亚太催化会
  台湾, 2013-10-13

Stochastic Surface Walking Method and   Its Applications in Electro-Photo Catalysis

刘智攀

5

15th Asian Chemical Congress 亚洲化学大会
  新加坡, 2013-8-19

Stochastic Surface Walking Method for   Electro-photo Catalysis

刘智攀

6

Symposium on New Theoretical Concepts and Directions   in Catalysis
  Santa Barbara, 2013-8-27

The stochastic surface walking method   and its application in catalysis

刘智攀

7

Workshop on Modeling Rare Events in Complex Physical   Systems
  新加坡, 2013-11-5

Stochastic Surface Walking Method and Beyond

刘智攀

8

245^th ACS national meeting (New Orleans   April 2013)
  New Orleans, 2013-4-7

Recent Progress In Theoretical   Catalysis: Automated Reaction Pathway Sampling And Solid-liquid Interface   Catalysis

刘智攀

9

6^th WCTCC 世界华人理论化学大会
  台湾淡水, 2013-6-24

Stochastic Surface Walking Method for   Theoretical Catalysis

刘智攀

10

The second Sino-French conference on green chemistry  
  Lyon, 2013-01-14

Thermochemistry for Conversion of   5-Choromethylfurfural (CMF) into Valuable Chemicals

徐昕

11

1st Symposium of Theoretical Chemistry Center,   Tsinghua University (TCC-THU), The Frontiers of Chemical Bonding Theory
   北京, 2013-05-17

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

徐昕

12

International Symposium on Computational Catalysis   for Energy Chemical Engineering
   天津, 2013-05-21

A new insight into the initial step in the   Fischer–Tropsch synthesis: CO dissociation on Ru surfaces

徐昕

13

4th Chinese-French Workshop in Theoretical Chemistry   (CFWTC2013)
  南京, 2013-06-02

Fractional charge behaviour and band gap predictions   with the XYG3 type of doubly hybrid density functionals

徐昕

14

The 6th world-wide Chinese Theoretical and   Computational Chemistry Conference (WCTCC)
  台湾, 2013-06-26

Fractional charge behaviour and band gap predictions   with the XYG3 type of doubly hybrid density functionals

徐昕

15

Workshop on Computational Methods for Complex   Systems
  台湾, 2013-06-27

Hybrid methods for accurate and efficient modeling   of large systems

徐昕

16

International Conference on Theoretical and High   Performance Computational Chemistry 2013(ICT-HPCC13)
   大连, 2013-07-21~25

Fractional charge behaviour and band gap predictions   with the XYG3 type of doubly hybrid density functionals

徐昕

17

第13届全国化学动力学会议
  安徽, 2013-08-23~26

Development of New Density Functionals: Towards   Accurate Descriptions of Potential Energy Surfaces

徐昕

18

the 246th American Chemical Society National Meeting
  Indianapolis, 2013-09-11

How well can we do computational heterogeneous   catalysis ? - A Caveat !”Theory and Simulation in Energy Production, Storage,   and Utilization

徐昕

19

International Conference on Computational Modeling   Methods and Applications (ICCMMA)
  长春, 2013-09-26~30.

Fractional charge behaviour and band gap predictions   with the XYG3 type of doubly hybrid density functionals

徐昕

20

The First International Workshop on Computational   Science and Engineering (IWCSE 2013)
  台湾, 2013-09-14~17

Fractional charge behaviour and band gap predictions   with the XYG3 type of doubly hybrid density functionals

徐昕

21

第十二届全国计算（机）化学学术会议
  苏州, 2013-10-21~24 .

新一代密度泛函方法XYG3

徐昕

22

The International Symposium on Computational   Sciences (ISCS2013),
  上海, 2013-11-18~20

Fractional charge behaviour and band gap predictions   with the XYG3 type of doubly hybrid density functionals

徐昕

23

2013 Hong Kong Workshop in Computer Modeling of   Complex Processes
  Hong Kong, 2013-12-18

How well can we do computational heterogeneous   catalysis ? - A Caveat !

徐昕

24

2013 APS March Meeting
   Baltimore, March 2013

Spin-Orbital States in Layered Cobaltates

吴骅

25

Advanced Molecular Simulation Methods in the   Physical Sciences
  北京,2013-06-10

Peptide self-assembly studied by molecular dynamics   simulations

韦广红

26

第三届复杂体系计算统计力学研讨会
  江苏,2013-10-25

多肽聚集和自组装

韦广红

27

2013美国生物物理学会会议
  韩国,2013-5-19

Lipid Interaction and Membrane Perturbation of Human   Amylin by Molecular Dynamics Simulations

韦广红

28

The 8th International Conference on Computational   Physics
  香港，2013 Jan 7-11

Efficient minimum mode finding in transition states   calculations

高卫国

29

APS March Meeting
  Baltimore, 2013 Mar 18-22

Efficient minimum mode finding in transition states   calculations

高卫国

30

Workshop on Multiscale Modeling, Analysis, and   Computation of Nano-Optics
  Michigan, 2013 Mar 23-24

Solving eigenvalue problems in Kohn-Sham density   functional theory

高卫国

31

Conference on Interdisciplinary Applied and   Computational Mathematics
  浙江, 2013 Jun 19-22

Solving nonlinear eigenvalue problem in resonant   tunneling diodes

高卫国

32

The Second Pacific Rim Mathematical Association   Congress
  上海, 2013 Jun 24-28

Solving nonlinear eigenvalue problem in resonant   tunneling diodes

高卫国

33

Workshop on Computational Problems in Material   Sciences
  苏州, 2013 Aug 22-23

Fast Algorithms for Transition State Calculations

高卫国

34

第十二届全国高校计算数学年会
  湖南, 2013 Oct 19-22

过渡态(一阶鞍点)第一性计算的高效算法

高卫国

35

Workshop on Modeling Rare Events in Complex Physical   Systems
  Singapore, 2013 Nov 5-8

Fast Algorithms for Transition State Calculations

高卫国

36

CAM-ICCM Workshop on Numerical Linear Algebra and   High Performance Computing
  台湾, 2013 Dec 9-13

Solving nonlinear eigenvalue problem in   resonant tunneling diodes

高卫国

37

2013 Shanghai International Conference on Matrix   Analysis and Applications
  上海, 2013 Dec 28-Dec 30

Variational deflation for nonlinear   eigenvalue problem in resonant tunneling diodes

高卫国

38

25^th Annual Workshop on Recent   Developments in Electronic Structure Theory
  Virginia, 2013 June 11-14

Progress in computational design on semiconductor   solar absorber

龚新高

39

The 1^st International Conference on   Phononics and Thermal Energy Science (PTES2013)
  上海, 2013 Sept. 2-4

Interface Effect on Thermal Conduction of   Nanomaterials and its Manipulation

龚新高

40

ChinaNano-2013
  北京, 2013 Sept. 5-7

Towards reliable design of energy materals:   electronic structure, stability and defects

龚新高

41

International Symposium on Nanostructures and Their   Applications in Renewable Energy
  北京, 2013 Oct. 25-27

Interface Effect on Thermal Conduction of   Nanomaterials and its Manipulation

龚新高

42

Conference on Frontiers of Condensed Matter Physics
  Trieste, 2013 Nov. 11-15

Towards reliable design of energy materals:   electronic structure, stability and defects

龚新高