杨祚银:男,副教授、硕士生导师。
电话:010-64444919;
电子邮箱:yangzy@mail.buct.edu.cn
v 教育经历:
1988.9-1991.7 山西大学分子科学研究所 硕士研究生 获理学硕士学位
1998.9-2001.7 南开大学化学系 博士研究生 获理学博士学位
2001.8-2003.6 北京师范大学化学系 博士后
v 工作经历:
1991.7-1998.8 山西太原钢铁集团钢铁研究所
2003.7-至今 北京化工大学
v 学术**:
中国化学学会会员;
v 主要研究领域:
主要研究领域是应用量子化学,比如化学反应的机理以及分子分子反应器对其内相反应的调控、可燃冰的笼型基本结构崩陷过程的能量变化等
v 代表性论文:
[1] Theoretical Study on the Tautomerization Reaction Formamide to Formamidic Acid Encapsulated in a Nano-sized Molecular Container, CHEM. RES. CHINESE UNIVERSITIES, 2009,25(1) 110-115
[2] Theoretical Study on Conformational Conversion of 1, 3-Dioxane inside a Capsular Host CHEM. RES. CHINESE UNIVERSITIES, 2008,24(2)241-245
[3] Theoretical probes of the host-guest complex: H-substituted cyclohexane encapsulated inside a self-assembled capsule, Journal of Molecular Structure: THEOCHEM. 2007, 819: 153-159
[4] Geometries and properties of bimetallic phosphido-bridged complex Cp(CO)2W(l-PPh2)W(CO)5 and Cp(CO)3W(l-PPh2)W(CO)5, Chem. Phys. 2007, 332: 33-38
[5] Theoretical study on conformational conversion of cyclohexane inside two cylindrical molecular capsules, Journal of Molecular Structure: THEOCHEM. 2006, 772: 39-44
[6] Computational Study of the Rearrangement Reaction Mechanism of Phenylcarbene in a Molecular Container: Cram’s Hemicarcerand, Journal of Molecular Structure: THEOCHEM. 2006,766:169-175
[7] Molecular and quantum mechanical studies on the monomer recognition of a highly-regular β- helical antifreeze protein. Science in China Ser. B,2004: 47(1), 34-40
[8] Computational Study on the Function of Water within a β-Helix Antifreeze Protein Dimer and in the Process of Ice-Protein Binding,Biophys. J. 2003, 85(4): 2599-2605
v 招生专业:
物理化学(含化学物理)
v 招生要求:
基础知识扎实,善于思考,脚踏实地