화학공학소재연구정보센터
검색결과 : 48건
No. Article
1 Chemical and mechanical degradation and mitigation strategies for Si anodes
Galvez-Aranda DE, Verma A, Hankins K, Seminario JM, Mukherjee PP, Balbuena PB
Journal of Power Sources, 419, 208, 2019
2 Simulations of a LiF Solid Electrolyte Interphase Cracking on Silicon Anodes Using Molecular Dynamics
Galvez-Aranda DE, Seminario JM
Journal of the Electrochemical Society, 165(3), A717, 2018
3 CO2 Capture and Separations Using MOFs: Computational and Experimental Studies
Yu JM, Xie LH, Li JR, Ma YG, Seminario JM, Balbuena PB
Chemical Reviews, 117(14), 9674, 2017
4 Solvation of Actinide Salts in Water Using a Polarizable Continuum Model
Kumar N, Seminario JM
Journal of Physical Chemistry A, 119(4), 689, 2015
5 Electron transfer through solid-electrolyte-interphase layers formed on Si anodes of Li-ion batteries
Benitez L, Cristancho D, Seminario JM, de la Hoz JMM, Balbuena PB
Electrochimica Acta, 140, 250, 2014
6 Metal-Ion Effects on the Polarization of Metal-Bound Water and Infrared Vibrational Modes of the Coordinated Metal Center of Mycobacterium tuberculosis Pyrazinamidase via Quantum Mechanical Calculations
Salazar-Salinas K, Baldera-Aguayo PA, Encomendero-Risco JJ, Orihuela M, Sheen P, Seminario JM, Zimic M
Journal of Physical Chemistry B, 118(34), 10065, 2014
7 Calculating the Hydrodynamic Volume of Poly(ethylene oxylated) Single-Walled Carbon Nanotubes and Hydrophilic Carbon Clusters
Bobadilla AD, Samuel ELG, Tour JM, Seminario JM
Journal of Physical Chemistry B, 117(1), 343, 2013
8 Light-Activated Molecular Conductivity in the Photoreactions of Vitamin D-3
Rangel NL, Williams KS, Seminario JM
Journal of Physical Chemistry A, 113(24), 6740, 2009
9 Transverse Electronic Transport in Double-Stranded DNA Nucleotides
Jauregui LA, Salazar-Salinas K, Seminario JM
Journal of Physical Chemistry B, 113(18), 6230, 2009
10 Switchable Molecular Conductivity
Wang K, Rangel NL, Kundu S, Sotelo JC, Tovar RM, Seminario JM, Liang H
Journal of the American Chemical Society, 131(30), 10447, 2009