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2007-09-18:
Ab initio Calculation of Elastic Properties of Rock-Salt and Zinc-Blend MgS under Pressure
2007-09-18:
Ab initio Calculation of Elastic Properties of Rock-Salt and Zinc-Blend MgS under Pressure
2007-06-11:
纳米材料弹性性质的计算
2007-06-11:
纳米材料弹性性质的计算
2007-03-26:
弹性常数的计算
2007-03-26:
弹性常数的计算
2007-01-25:
工作报告
2007-01-25:
工作报告
2006-10-19:
High pressure reactivity of propene by first principles molecular dynamics calculations
2006-10-19:
High pressure reactivity of propene by first principles molecular dynamics calculations
2006-06-30:
work results
2006-06-30:
work results
2006-06-11:
Metadynamics (MTD) Method in Molecular Dynamics (include CMD and Ab-initio MD)
2006-06-11:
Metadynamics (MTD) Method in Molecular Dynamics (include CMD and Ab-initio MD)
2006-05-28:
High-Pressure-Induced Phase Transitions in Pentaerythritol: X-ray and Raman Studies
2006-05-28:
High-Pressure-Induced Phase Transitions in Pentaerythritol: X-ray and Raman Studies
2006-05-14:
High Pressure Study of C6H12
2006-05-14:
High Pressure Study of C6H12
2006-04-09:
Raman and X-Ray Scattering Studies of High-Pressure Phases of Urea
2006-04-09:
Raman and X-Ray Scattering Studies of High-Pressure Phases of Urea
2006-03-22:
Ultrahigh-pressure transition in solid hydrogen
2006-03-22:
Ultrahigh-pressure transition in solid hydrogen
2006-01-13:
Ab initio simulation of FeS2(pyrite) at high pressure
2006-01-13:
Ab initio simulation of FeS2(pyrite) at high pressure
2005-11-09:
Melting Curve and High-Pressure Chemistry of Formic Acid to 8 GPa and 600 K
2005-10-19:
Result of glycine calculated by classical MD
2005-09-28:
Simulation Result of Glycine
2005-06-24:
SIMULATION RESULTS of CH3COOH AND FUTURE WORK
2005-05-18:
Ab initio molecular dynamics study of glycine intramolecular proton transfer in water
2005-04-20:
WORK PROGRESS(2)
2005-04-06:
WORK PROGRESS
2005-03-16:
Molecular Dynamics Simulation of Acetic Acid Crystal
2005-01-19:
Summarization of This Term
2005-01-05:
Two special examples of MD Simulation
2004-12-22:
Some Results
2004-12-08:
Molecular Dynamics Simulation of the Surface Pressure of Colloidal monolayers
2004-11-24:
WORK PROGRESS
2004-11-03:
Introduction to Ab Initio Molecular Dynamics
2004-10-13:
Extended methods of molecular dynamic simulations under hydrostatic
2004-09-22:
WORK PROGRESS
2004-09-07:
Density functional calculations of the structure of crystalline urea under high pressure
2004-06-03:
Molecular dynamics study of pressure in molecular systems
2004-04-15:
HIGH PRESSURE CALCULATION ABOUT BENZE
2004-02-19:
高压物理实验模拟原理--能量极小值方法
2004-01-07:
高压物理实验模拟工作进展(2)
2003-11-27:
高压物理实验模拟工作进展(1)
2003-10-09:
高压物理实验模拟原理