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× Density Functional Theory
1 Computational Discovery of Metal-Organic Frameworks for Carbon Capture and Natural Gas Storage. [学位论文]
作者:Koh, Hyun SeungLu, Wei
论文开放时间:2014
关键词:Metal-Organic Frameworks;Density Functional Theory;...
培养单位:University of Michigan
作者:Hendrickson, Heidi PhillipsBricker, Leah Ann
论文开放时间:2015
关键词:Density Functional Theory;Time-Dependent Density Functional Theory;...
培养单位:University of Michigan
作者:Brewer, Scott Harmon;Stefan Franzen, Committee Chair,Edmond Bowden, Committee Member,Daniel Feldheim, Committee Member,Jan Genzer, Committee Member,Brewer, Scott Harmon;Stefan Franzen;等
论文开放时间:2005
关键词:Protein Folding;FTIR;...
培养单位:University:North Carolina State University
作者:de Koker, Nico Pieter JanRuff, Larry John
论文开放时间:2008
关键词:Melt;Deep Earth;...
培养单位:University of Michigan
作者:Schneider, Curtis J.Penner-Hahn, James E.
论文开放时间:2009
关键词:Vanadium Dependent Haloperoxidases;Peroxovanadium;...
培养单位:University of Michigan
6 Density Functional Theory Studies on the Relative Reactivity ofChloroethenes on Zerovalent Iron. [学位论文]
作者:Lim, Dong HeeWooldridge, Margaret S.
论文开放时间:2008
关键词:Dechlorination Mechanism of Reductive Beta-elimination;Density Functional Theory;...
培养单位:University of Michigan