화학공학소재연구정보센터
검색결과 : 28건
No. Article
1 Editorial: Modern Architectures and Their Impact on Electronic Structure Theory
Gordon MS, Windus TL
Chemical Reviews, 120(17), 9015, 2020
2 Correlation Energy Extrapolation by Many-Body Expansion
Boschen JS, Theis D, Ruedenberg K, Windus TL
Journal of Physical Chemistry A, 121(4), 836, 2017
3 Computational Study of the Malonic Acid Tautomerization Products in Highly Concentrated Particles
Dick-Perez M, Windus TL
Journal of Physical Chemistry A, 121(11), 2259, 2017
4 Preface: Mark S. Gordon
Windus TL, Baldridge KK, Schmidt MW, Aikens CM
Journal of Physical Chemistry A, 121(14), 2715, 2017
5 Computer-Aided Molecular Design of Bis-phosphine Oxide Lanthanide Extractants
McCann BW, De Silva N, Windus TL, Gordon MS, Moyer BA, Bryantsev VS, Hay BP
Inorganic Chemistry, 55(12), 5787, 2016
6 Conformations of Organophosphine Oxides
De Silva N, Zahariev F, Hay BP, Gordon MS, Windus TL
Journal of Physical Chemistry A, 119(32), 8765, 2015
7 Valence Virtual Orbitals: An Unambiguous ab Initio Quantification of the LUMO Concept
Schmidt MW, Hull EA, Windus TL
Journal of Physical Chemistry A, 119(41), 10408, 2015
8 Highly Enantioselective Zirconium-Catalyzed Cyclization of Aminoalkenes
Manna K, Everett WC, Schoendorff G, Ellern A, Windus TL, Sadow AD
Journal of the American Chemical Society, 135(19), 7235, 2013
9 Roles of Acetone and Diacetone Alcohol in Coordination and Dissociation Reactions of Uranyl Complexes
Rios D, Schoendorff G, Van Stipdonk MJ, Gordon MS, Windus TL, Gibson JK, de Jong WA
Inorganic Chemistry, 51(23), 12768, 2012
10 On the Formation of "Hypercoordinated" Uranyl Complexes
Schoendorff G, de Jong WA, Van Stipdonk MJ, Gibson JK, Rios D, Gordon MS, Windus TL
Inorganic Chemistry, 50(17), 8490, 2011