화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 Structural Evolution of High-Rank Coals during Coalification and Graphitization: X-ray Diffraction, Raman Spectroscopy, High-Resolution Transmission Electron Microscopy, and Reactive Force Field Molecular Dynamics Simulation Study
Zhang S, Song BT, Cao CX, Zhang H, Liu QF, Li K, Teppen BJ
Energy & Fuels, 35(3), 2087, 2021
2 TCDD administered on activated carbon eliminates bioavailability and subsequent shifts to a key murine gut commensal
Stedtfeld RD, Sallach JB, Crawford RB, Stedtfeld TM, Williams MR, Waseem H, Johnston CT, Li H, Teppen BJ, Kaminski NE, Boyd SA, Tiedje JM, Hashsham SA
Applied Microbiology and Biotechnology, 101(19), 7409, 2017
3 Quantum molecular dynamics simulations regarding the dechlorination of trichloro ethene in the interlayer space of the 2 : 1 clay mineral nontronite
Teppen BJ, Yu CH, Newton SQ, Miller DM, Schafer L
Journal of Physical Chemistry A, 106(22), 5498, 2002
4 Molecular-Dynamics Modeling of Clay-Minerals .1. Gibbsite, Kaolinite, Pyrophyllite, and Beidellite
Teppen BJ, Rasmussen K, Bertsch PM, Miller DM, Schafer L
Journal of Physical Chemistry B, 101(9), 1579, 1997
5 Tautomeric Equilibria of 3-Hydroxypyrazole in the Gas-Phase and in Solution - A Theoretical-Study Combining Ab-Initio Quantum-Mechanics and Monte-Carlo Simulation Methods
Cao M, Teppen BJ, Miller DM, Pranata J, Schafer L
Journal of Physical Chemistry, 98(44), 11353, 1994
6 Choice of Computational Techniques and Molecular-Models for Ab-Initio Calculations Pertaining to Solid Silicates
Teppen BJ, Miller DM, Newton SQ, Schafer L
Journal of Physical Chemistry, 98(48), 12545, 1994