화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 A Dissociative Quantum Mechanical/Molecular Mechanical Molecular Dynamics Simulation and Infrared Experiments Reveal Characteristics of the Strongly Hydrolytic Arsenic(III)
Canaval LR, Lutz OMD, Weiss AKH, Huck CW, Hofer TS
Inorganic Chemistry, 53(22), 11861, 2014
2 Electronic Structure and Hydration of Tetramine Cobalt Hydride Complexes
Bhattacharjee A, Weiss AKH, Artero V, Field MJ, Hofer TS
Journal of Physical Chemistry B, 118(20), 5551, 2014
3 A Comparative Quantum Mechanical Charge Field Study of Uranyl Mono- and Dicarbonate Species in Aqueous Solution
Tirler AO, Weiss AKH, Hofer TS
Journal of Physical Chemistry B, 117(50), 16174, 2013
4 A QMCF-MD Investigation of the Structure and Dynamics of Ce4+ in Aqueous Solution
Lutz OMD, Hofer TS, Randolf BR, Weiss AKH, Rode BM
Inorganic Chemistry, 51(12), 6746, 2012
5 Hydration of highly charged ions
Hofer TS, Weiss AKH, Randolf BR, Rode BM
Chemical Physics Letters, 512(4-6), 139, 2011
6 Structure and Dynamics of the Chromate Ion in Aqueous Solution. An ab Initio QMCF-MD Simulation
Hinteregger E, Pribil AB, Hofer TS, Randolf BR, Weiss AKH, Rode BM
Inorganic Chemistry, 49(17), 7964, 2010