David S. Sholl
David S. Sholl
School Chair, Michael Tennenbaum Family Chair and GRA Eminent Scholar in Energy Sustainability, Georgia Institute of Technology
在 chbe.gatech.edu 的電子郵件地址已通過驗證 - 首頁
標題
引用次數
引用次數
年份
Density functional theory: a practical introduction
D Sholl, JA Steckel
John Wiley & Sons, 2011
16172011
Seven chemical separations to change the world
DS Sholl, RP Lively
Nature News 532 (7600), 435, 2016
14392016
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
8932005
Rapid transport of gases in carbon nanotubes
AI Skoulidas, DM Ackerman, JK Johnson, DS Sholl
Physical review letters 89 (18), 185901, 2002
7602002
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
5602010
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
4382005
Chiral selection on inorganic crystalline surfaces
RM Hazen, DS Sholl
Nature materials 2 (6), 367-374, 2003
4372003
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
4292014
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
3882009
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
3242010
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
3202009
Ultem®/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
3122012
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
3032006
Quantum sieving in carbon nanotubes and zeolites
Q Wang, SR Challa, DS Sholl, JK Johnson
Physical Review Letters 82 (5), 956, 1999
2831999
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
2752015
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
2742010
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
2722005
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
2712013
Scalable fabrication of carbon nanotube/polymer nanocomposite membranes for high flux gas transport
S Kim, JR Jinschek, H Chen, DS Sholl, E Marand
Nano letters 7 (9), 2806-2811, 2007
2682007
Making high-flux membranes with carbon nanotubes
DS Sholl, JK Johnson
Science 312 (5776), 1003-1004, 2006
2682006
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