David S. Sholl
David S. Sholl
School Chair, Michael Tennenbaum Family Chair and GRA Eminent Scholar in Energy Sustainability, Georgia Institute of Technology
Verified email at chbe.gatech.edu - Homepage
Title
Cited by
Cited by
Year
Density functional theory: a practical introduction
D Sholl, JA Steckel
John Wiley & Sons, 2011
15922011
Seven chemical separations to change the world
DS Sholl, RP Lively
Nature News 532 (7600), 435, 2016
14042016
TCE dechlorination rates, pathways, and efficiency of nanoscale iron particles with different properties
Y Liu, SA Majetich, RD Tilton, DS Sholl, GV Lowry
Environmental science & technology 39 (5), 1338-1345, 2005
8902005
Rapid transport of gases in carbon nanotubes
AI Skoulidas, DM Ackerman, JK Johnson, DS Sholl
Physical review letters 89 (18), 185901, 2002
7572002
Can metal–organic framework materials play a useful role in large‐scale carbon dioxide separations?
S Keskin, TM van Heest, DS Sholl
ChemSusChem 3 (8), 879-891, 2010
5572010
Rejection of organic micropollutants (disinfection by-products, endocrine disrupting compounds, and pharmaceutically active compounds) by NF/RO membranes
K Kimura, G Amy, JE Drewes, T Heberer, TU Kim, Y Watanabe
Journal of membrane science 227 (1-2), 113-121, 2003
4762003
Chiral selection on inorganic crystalline surfaces
RM Hazen, DS Sholl
Nature materials 2 (6), 367-374, 2003
4352003
Self-diffusion and transport diffusion of light gases in metal-organic framework materials assessed using molecular dynamics simulations
AI Skoulidas, DS Sholl
The Journal of Physical Chemistry B 109 (33), 15760-15768, 2005
4342005
Computation-ready, experimental metal–organic frameworks: A tool to enable high-throughput screening of nanoporous crystals
YG Chung, J Camp, M Haranczyk, BJ Sikora, W Bury, V Krungleviciute, ...
Chemistry of Materials 26 (21), 6185-6192, 2014
4222014
Nanoscale design to enable the revolution in renewable energy
J Baxter, Z Bian, G Chen, D Danielson, MS Dresselhaus, AG Fedorov, ...
Energy & Environmental Science 2 (6), 559-588, 2009
3852009
Progress, opportunities, and challenges for applying atomically detailed modeling to molecular adsorption and transport in metal− organic framework materials
S Keskin, J Liu, RB Rankin, JK Johnson, DS Sholl
Industrial & Engineering Chemistry Research 48 (5), 2355-2371, 2009
3192009
Chemically meaningful atomic charges that reproduce the electrostatic potential in periodic and nonperiodic materials
TA Manz, DS Sholl
Journal of Chemical Theory and Computation 6 (8), 2455-2468, 2010
3182010
UltemŽ/ZIF-8 mixed matrix hollow fiber membranes for CO2/N2 separations
Y Dai, JR Johnson, O Karvan, DS Sholl, WJ Koros
Journal of Membrane Science 401, 76-82, 2012
3062012
Identification of destabilized metal hydrides for hydrogen storage using first principles calculations
SV Alapati, JK Johnson, DS Sholl
The Journal of Physical Chemistry B 110 (17), 8769-8776, 2006
3012006
Quantum sieving in carbon nanotubes and zeolites
Q Wang, SR Challa, DS Sholl, JK Johnson
Physical Review Letters 82 (5), 956, 1999
2821999
The materials genome in action: identifying the performance limits for methane storage
CM Simon, J Kim, DA Gomez-Gualdron, JS Camp, YG Chung, RL Martin, ...
Energy & Environmental Science 8 (4), 1190-1199, 2015
2722015
Prediction of hydrogen flux through sulfur-tolerant binary alloy membranes
P Kamakoti, BD Morreale, MV Ciocco, BH Howard, RP Killmeyer, ...
Science 307 (5709), 569-573, 2005
2712005
Exploring the framework hydrophobicity and flexibility of ZIF-8: from biofuel recovery to hydrocarbon separations
K Zhang, RP Lively, C Zhang, RR Chance, WJ Koros, DS Sholl, S Nair
The Journal of Physical Chemistry Letters 4 (21), 3618-3622, 2013
2702013
Efficient calculation of diffusion limitations in metal organic framework materials: a tool for identifying materials for kinetic separations
E Haldoupis, S Nair, DS Sholl
Journal of the American Chemical Society 132 (21), 7528-7539, 2010
2702010
Making high-flux membranes with carbon nanotubes
DS Sholl, JK Johnson
Science 312 (5776), 1003-1004, 2006
2682006
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Articles 1–20