商城中文主页--论文成果

电子邮箱：cshang@fudan.edu.cn
所在单位：化学系
学历：研究生毕业
办公地点：复旦大学江湾校区化学楼A3018
联系方式：021-31249136
学位：博士学位
职称：教授
在职信息：在职
毕业院校：复旦大学
博士生导师
硕士生导师

论文成果

当前位置: 中文主页 >> 科学研究 >> 论文成果

[16] In Situ Active Site for CO Activation in Fe-Catalyzed Fischer-Tropsch Synthesis from Machine Lear... JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2021, 143(29): 11109-11120
[17] The dome of gold nanolized for catalysis Chemical Science, 2021, 12(15): 5664-5671
[18] Is Transition Metal Oxide a Must? Moisture-Assisted Oxygen Activation in CO Oxidation on Gold/gam... Journal of Physical Chemistry C, 2010, 114(40): 16989-16995
[19] 大规模原子模拟软件包(LSASP)程序设计和进展中国科学基金, 2018, 32(1): 95-100
[20] Sharp Increase in Catalytic Selectivity in Acetylene Semihydrogenation on Pd Achieved by a Machin... ACS Catalysis, 2020, 10(17): 9694-9705
[21] Glassy nature and glass-to-crystal transition in the binary metallic glass CuZr PHYSICAL REVIEW B, 2017, 95(21):
[22] Pressure-induced silica quartz amorphization studied by iterative stochastic surface walking reac... Physical Chemistry Chemical Physics, 2017, 19(6): 4725-4733
[23] Atomic structure of boron resolved using machine learning and global sampling Chemical Science, 2018, 9(46): 8644-8655
[24] Constrained Broyden Minimization Combined with the Dimer Method for Locating Transition State of ... Journal of Chemical Theory and Computation, 2010, 6(4): 1136-1144
[25] Origin and Activity of Gold Nanoparticles as Aerobic Oxidation Catalysts in Aqueous Solution Journal of the American Chemical Society, 2011, 133(25): 9938-9947
[26] Constrained Broyden Dimer Method with Bias Potential for Exploring Potential Energy Surface of Mu... Journal of Chemical Theory and Computation, 2012, 8(7): 2215-2222
[27] Stochastic Surface Walking Method for Structure Prediction and Pathway Searching Journal of Chemical Theory and Computation, 2013, 9(3): 1838-1845
[28] From Atoms to Fullerene: Stochastic Surface Walking Solution for Automated Structure Prediction o... Journal of Chemical Theory and Computation, 2013, 9(7): 3252-3260
[29] Double-Ended Surface Walking Method for Pathway Building and Transition State Location of Complex... Journal of Chemical Theory and Computation, 2013, 9(12): 5745-5753
[30] Efficient softest mode finding in transition states calculations Journal of Chemical Physics, 2013, 138(9):

共44条 2/3

首页上页下页尾页页