Elastic constants and related properties of tetrahedrally bonded BN, AlN, GaN, and InN K Kim, WRL Lambrecht, B Segall
Physical Review B 53 (24), 16310, 1996
948 1996 First-principles study of native defects in anatase S Na-Phattalung, MF Smith, K Kim, MH Du, SH Wei, SB Zhang, ...
Physical Review B—Condensed Matter and Materials Physics 73 (12), 125205, 2006
469 2006 Effective masses and valence-band splittings in GaN and AlN K Kim, WRL Lambrecht, B Segall, M Van Schilfgaarde
Physical Review B 56 (12), 7363, 1997
336 1997 Spatial correlations in GaInAsN alloys and their effects on band-gap enhancement and electron localization K Kim, A Zunger
Physical Review Letters 86 (12), 2609, 2001
315 2001 Electronic structure of GaN with strain and phonon distortions K Kim, WRL Lambrecht, B Segall
Physical Review B 50 (3), 1502, 1994
275 1994 Finding gas diffusion pathways in proteins: application to O2 and H2 transport in CpI [FeFe]-hydrogenase and the role of packing defects J Cohen, K Kim, P King, M Seibert, K Schulten
Structure 13 (9), 1321-1329, 2005
252 2005 Hydroxide degradation pathways for substituted trimethylammonium cations: a DFT study H Long, K Kim, BS Pivovar
The Journal of Physical Chemistry C 116 (17), 9419-9426, 2012
227 2012 Theoretical studies on conjugated phenyl-cored thiophene dendrimers for photovoltaic applications ME Köse, WJ Mitchell, N Kopidakis, CH Chang, SE Shaheen, K Kim, ...
Journal of the American Chemical Society 129 (46), 14257-14270, 2007
218 2007 Determination of the band-gap energy of Al1 - x Inx N grown by metal-organic chemical-vapor deposition KS Kim, A Saxler, P Kung, M Razeghi, KY Lim
Applied physics letters 71 (6), 800-802, 1997
162 1997 Molecular dynamics and experimental investigation of H2 and O2 diffusion in [Fe]-hydrogenase J Cohen, K Kim, M Posewitz, ML Ghirardi, K Schulten, M Seibert, P King
Biochemical Society Transactions 33 (1), 80-82, 2005
148 2005 Approaches to developing biological H2 -photoproducing organisms and processes ML Ghirardi, PW King, MC Posewitz, PC Maness, A Fedorov, K Kim, ...
Biochemical Society Transactions 33 (1), 70-72, 2005
126 2005 Divacancy-nitrogen-assisted transition metal dispersion and hydrogen adsorption in defective graphene: A first-principles study WI Choi, SH Jhi, K Kim, YH Kim
Physical Review B—Condensed Matter and Materials Physics 81 (8), 085441, 2010
117 2010 Density functional theory calculation of bonding and charge parameters for molecular dynamics studies on [FeFe] hydrogenases CH Chang, K Kim
Journal of chemical theory and computation 5 (4), 1137-1145, 2009
91 2009 Shape dependence of band-edge exciton fine structure in CdSe nanocrystals Q Zhao, PA Graf, WB Jones, A Franceschetti, J Li, Wang, K Kim
Nano letters 7 (11), 3274-3280, 2007
72 2007 Atomistic description of the electronic structure of In x Ga 1− x As alloys and InAs/GaAs superlattices K Kim, PRC Kent, A Zunger, CB Geller
Physical Review B 66 (4), 045208, 2002
62 2002 Atomic resolution modeling of the ferredoxin:[FeFe] hydrogenase complex from Chlamydomonas reinhardtii CH Chang, PW King, ML Ghirardi, K Kim
Biophysical journal 93 (9), 3034-3045, 2007
60 2007 Structure and phonons of WRL Lambrecht, E Alldredge, K Kim
Physical Review B—Condensed Matter and Materials Physics 72 (15), 155202, 2005
59 2005 Brownian dynamics and molecular dynamics study of the association between hydrogenase and ferredoxin from Chlamydomonas reinhardtii H Long, CH Chang, PW King, ML Ghirardi, K Kim
Biophysical journal 95 (8), 3753-3766, 2008
57 2008 Charge transport simulations in conjugated dendrimers ME Köse, H Long, K Kim, P Graf, D Ginley
The Journal of Physical Chemistry A 114 (12), 4388-4393, 2010
51 2010 Instability of the high-pressure CsCl structure in most III-V semiconductors K Kim, V Ozoliņš, A Zunger
Physical Review B 60 (12), R8449, 1999
44 1999