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会议日程
2005年5月23日
07:45
Breakfast
chair: YP Wang & RQ Zhang
8:45 Opening
CL Yang
XB Chi
WJ liu
9:15－9:45
WJ Liu
Time-Dependent Relativistic density
functional theory
9:45－10:15
KL Han
Correlation
Quantum Dynamics between Electron and D2+ Molecule with
Attosecond Resolution
10:15—10:45 CL
Yang
CH4＋F全维势能面
10:45—11:00
Break
11:00—11:30 RQ
Zhang
Towards design of nanosensor for
biodetection through computation
11:30—12:00 XQ
Wang
Introduction to Density Matrix
Renormalization Group Method
12:00—12:30 ZD
Wang
Solid State Quantum Computing
12:30
Lunch
chair: WJ Liu & XQ Wang
14:30—15:00
JZH Zhang
Quantum chemical studies of proteins
15:00－15:30
XY Li
溶剂效应的连续介质模型
15:30—16:00
SH Li
Recent advances in ab initio calculations
of macromolecules
16:00—16:15
Break
16:15—16:45
WH Fang
Insights into photodissociation dynamics
of polyatomic molecules from ab initio calculations
16:45－17:15
X Xu
A newly developed density functional
X3LYP
17:15－17:45
QT Meng
？
18:00－
Dinner
2005年5月24日
07:45
Breakfast
chair: CL Yang & XR Wang
8:45－9:15
XC Xie
Spin current and spin Hall effect
9:15－9:45
YP Wang
Condensation of High-Spin Fermion Systems
9:45－10:15
ZY Wen
Xian-CI:Its
algorithm,structure,functions and applications
10:15—10:45 ZX
Cao
Spin-Orbit Coupling Effects in
Carbon-Rich Conjugated Systems
10:45—11:00
Break
11:00—11:30 HQ
Lin
Numerical Studies of Magnetism in Heavy
Fermion Systems
11:30—12:00 SQ
Shen
Spin Hall Effect and Related Issues
12:00—12:30 WT
Geng
Interplay of local structure and
magnetism in Co-doped TiO2 anatase
12:30
Lunch
chair: ZD Wang & HQ Lin
14:30—15:00
YS Zheng
(to be
announced)
15:00－15:30
J Wu
Generator Method for Symmetry-Adapted
Bases
15:30—16:00
YX Bu
Investigations of charge-proton transport
and coupling property in biological systems
16:00—16:15
Break
16:15—16:45
DH Zhang
Continuous configuration time-dependent self-consistent
field (CC-TDSCF) method for complex quantum systems
16:45－17:15
Professor Varandas
to be announced.
17:15－17:45
XR Wang
Self-Oscillation in current induced
magnetization reversal
18:00－
Dinner
20:00－20:30
B Shen
Introduction to The Virtual Lab for
Computational Chemistry
20:30－
Panel: KL Han, DS Wang, ZY Wen, XC Xie, JZH Zhang
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