화학공학소재연구정보센터
검색결과 : 19건
No. Article
1 Snapshots of Proton Accommodation at a Microscopic Water Surface: Understanding the Vibrational Spectral Signatures of the Charge Defect in Cryogenically Cooled H+(H2O)(n=2-28) Clusters
Fournier JA, Wolke CT, Johnson MA, Odbadrakh TT, Jordan KD, Kathmann SM, Xantheas SS
Journal of Physical Chemistry A, 119(36), 9425, 2015
2 Experimental and Theoretical Study of Molecular Response of Amine Bases in Organic Solvents
Kathmann SM, Cho H, Chang TM, Schenter GK, Parab K, Autrey T
Journal of Physical Chemistry B, 118(18), 4883, 2014
3 Study of Ion Specific Interactions of Alkali Cations with Dicarboxylate Dianions
Murdachaew G, Valiev M, Kathmann SM, Wang XB
Journal of Physical Chemistry A, 116(9), 2055, 2012
4 Analysis of the Activation and Heterolytic Dissociation of H-2 by Frustrated Lewis Pairs: NH3/BX3 (X = H, F, and Cl)
Camaioni DM, Ginovska-Pangovska B, Schenter GK, Kathmann SM, Autrey T
Journal of Physical Chemistry A, 116(26), 7228, 2012
5 Understanding the Surface Potential of Water
Kathmann SM, Kuo IFW, Mundy CJ, Schenter GK
Journal of Physical Chemistry B, 115(15), 4369, 2011
6 Theoretical Investigations on the Formation and Dehydrogenation Reaction Pathways of H(NH2BH2)(n)H (n=1-4) Oligomers: Importance of Dihydrogen Interactions
Li J, Kathmann SM, Hu HS, Schenter GK, Autrey T, Gutowski M
Inorganic Chemistry, 49(17), 7710, 2010
7 Ethanol synthesis from syngas over Rh-based/SiO2 catalysts: A combined experimental and theoretical modeling study
Mei DH, Rousseau R, Kathmann SM, Glezakou VA, Engelhard MH, Jiang WL, Wang CM, Gerber MA, White JF, Stevens DJ
Journal of Catalysis, 271(2), 325, 2010
8 Neutron Powder Diffraction and Molecular Simulation Study of the Structural Evolution of Ammonia Borane from 15 to 340 K
Hess NJ, Schenter GK, Hartman MR, Daemen LL, Proffen T, Kathmann SM, Mundy CJ, Hartl M, Heldebrant DJ, Stowe AC, Autrey T
Journal of Physical Chemistry A, 113(19), 5723, 2009
9 Hydrated Structure of Ag(I) Ion from Symmetry-Dependent, K- and L-Edge XAFS Multiple Scattering and Molecular Dynamics Simulations
Fulton JL, Kathmann SM, Schenter GK, Balasubramanian M
Journal of Physical Chemistry A, 113(50), 13976, 2009
10 Electronic Effects on the Surface Potential at the Vapor-Liquid Interface of Water (vol 130, 16556, 2008)
Kathmann SM, Kuo IFW, Mundy CJ
Journal of the American Chemical Society, 131(47), 17522, 2009