| A combined experimental-computational study on the effect of topology on carbon dioxide adsorption in zeolitic imidazolate frameworks W Morris, N He, KG Ray, P Klonowski, H Furukawa, IN Daniels, ... The Journal of Physical Chemistry C 116 (45), 24084-24090, 2012 | 185 | 2012 |
| Probing nanoscale solids at thermal extremes GE Begtrup, KG Ray, BM Kessler, TD Yuzvinsky, H Garcia, A Zettl Physical review letters 99 (15), 155901, 2007 | 141 | 2007 |
| A combined experimental–computational investigation of methane adsorption and selectivity in a series of isoreticular zeolitic imidazolate frameworks Y Houndonougbo, C Signer, N He, W Morris, H Furukawa, KG Ray, ... The Journal of Physical Chemistry C 117 (20), 10326-10335, 2013 | 98 | 2013 |
| Structural and vibrational properties of -MoO from van der Waals corrected density functional theory calculations H Ding, KG Ray, V Ozolins, M Asta Physical Review B—Condensed Matter and Materials Physics 85 (1), 012104, 2012 | 84 | 2012 |
| Phenyl/perfluorophenyl stacking interactions enhance structural order in two-dimensional covalent organic frameworks WA Braunecker, KE Hurst, KG Ray, ZR Owczarczyk, MB Martinez, N Leick, ... Crystal Growth & Design 18 (7), 4160-4166, 2018 | 60 | 2018 |
| Nanointerface-driven reversible hydrogen storage in the nanoconfined Li-NH system BC Wood, V Stavila, N Poonyayant, TW Heo, KG Ray, LE Klebanoff, ... Advanced Materials Interfaces 4 (SAND-2016-9601J; LLNL-JRNL-676756; LLNL …, 2017 | 48 | 2017 |
| A Mechanistic Analysis of Phase Evolution and Hydrogen Storage Behavior in Nanocrystalline Mg(BH4)2 within Reduced Graphene Oxide S Jeong, TW Heo, J Oktawiec, R Shi, SY Kang, JL White, A Schneemann, ... ACS nano 14 (2), 1745-1756, 2020 | 41 | 2020 |
| Gas membrane selectivity enabled by zeolitic imidazolate framework electrostatics KG Ray, DL Olmsted, JMR Burton, Y Houndonougbo, BB Laird, M Asta Chemistry of Materials 26 (13), 3976-3985, 2014 | 35 | 2014 |
| A density-functional theory study of the Al/AlOx/Al tunnel junction CE Kim, KG Ray, V Lordi Journal of applied physics 128 (15), 2020 | 34 | 2020 |
| Elucidating the mechanism of MgB 2 initial hydrogenation via a combined experimental–theoretical study KG Ray, LE Klebanoff, JRI Lee, V Stavila, TW Heo, P Shea, AA Baker, ... Physical Chemistry Chemical Physics 19 (34), 22646-22658, 2017 | 34 | 2017 |
| Spontaneous dynamical disordering of borophenes in MgB2 and related metal borides S Li, H Gunda, KG Ray, CS Wong, P Xiao, RW Friddle, YS Liu, SY Kang, ... Nature Communications 12 (1), 6268, 2021 | 33 | 2021 |
| Extreme thermal stability of carbon nanotubes GE Begtrup, KG Ray, BM Kessler, TD Yuzvinsky, H Garcia, A Zettl physica status solidi (b) 244 (11), 3960-3963, 2007 | 33 | 2007 |
| Nanoscale Mg–B via Surfactant Ball Milling of MgB2: Morphology, Composition, and Improved Hydrogen Storage Properties YS Liu, KG Ray, M Jørgensen, TM Mattox, DF Cowgill, HV Eshelman, ... The Journal of Physical Chemistry C 124 (39), 21761-21771, 2020 | 32 | 2020 |
| Origins of CH4/CO2 Adsorption Selectivity in Zeolitic Imidazolate Frameworks: A van der Waals Density Functional Study KG Ray, DL Olmsted, Y Houndonougbo, BB Laird, M Asta The Journal of Physical Chemistry C 117 (28), 14642-14651, 2013 | 28 | 2013 |
| van der Waals density functional study of CO binding in zeolitic imidazolate frameworks KG Ray, D Olmsted, N He, Y Houndonougbo, BB Laird, M Asta Physical Review B—Condensed Matter and Materials Physics 85 (8), 085410, 2012 | 28 | 2012 |
| Hydrogen storage in partially exfoliated magnesium diboride multilayers H Gunda, KG Ray, LE Klebanoff, C Dun, MAT Marple, S Li, P Sharma, ... Small 19 (6), 2205487, 2023 | 27 | 2023 |
| Investigating possible kinetic limitations to MgB2 hydrogenation YS Liu, LE Klebanoff, P Wijeratne, DF Cowgill, V Stavila, TW Heo, S Kang, ... International Journal of Hydrogen Energy 44 (59), 31239-31256, 2019 | 17 | 2019 |
| Assessing the reactivity of TiCl3 and TiF3 with hydrogen S Kang, LE Klebanoff, AA Baker, DF Cowgill, V Stavila, JRI Lee, ... international journal of hydrogen energy 43 (31), 14507-14519, 2018 | 16 | 2018 |
| Magnetic stability of oxygen defects on the SiO2 surface N Adelstein, D Lee, JL DuBois, KG Ray, JB Varley, V Lordi AIP Advances 7 (2), 2017 | 16 | 2017 |
| van der Waals-corrected density functional study of electric field noise heating in ion traps caused by electrode surface adsorbates KG Ray, BM Rubenstein, W Gu, V Lordi New Journal of Physics 21 (5), 053043, 2019 | 14 | 2019 |
Brandon C. WoodLEAF Director, Lawrence Livermore National LaboratoryVerified email at llnl.gov
