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Alauddin Ahmed
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Exceptional hydrogen storage achieved by screening nearly half a million metal-organic frameworks
A Ahmed, S Seth, J Purewal, AG Wong-Foy, M Veenstra, AJ Matzger, ...
Nature communications 10 (1), 1568, 2019
3582019
An assessment of strategies for the development of solid-state adsorbents for vehicular hydrogen storage
MD Allendorf, Z Hulvey, T Gennett, A Ahmed, T Autrey, J Camp, ES Cho, ...
Energy & Environmental Science 11 (10), 2784-2812, 2018
2052018
Balancing gravimetric and volumetric hydrogen density in MOFs
A Ahmed, Y Liu, J Purewal, LD Tran, AG Wong-Foy, M Veenstra, ...
Energy & Environmental Science 10 (11), 2459-2471, 2017
1612017
Solid-liquid equilibria and triple points of n-6 Lennard-Jones fluids
A Ahmed, RJ Sadus
The Journal of chemical physics 131 (17), 2009
1162009
Phase diagram of the Weeks-Chandler-Andersen potential from very low to high temperatures and pressures
A Ahmed, RJ Sadus
Physical Review E 80 (6), 061101, 2009
772009
Predicting Hydrogen Storage in MOFs via Machine Learning
A Ahmed, DJ Siegel
Patterns, 2020
682020
Computational screening of hydration reactions for thermal energy storage: new materials and design rules
S Kiyabu, JS Lowe, A Ahmed, DJ Siegel
Chemistry of Materials 30 (6), 2006-2017, 2018
612018
Estimation of system-level hydrogen storage for metal-organic frameworks with high volumetric storage density
J Purewal, M Veenstra, D Tamburello, A Ahmed, AJ Matzger, ...
international journal of hydrogen energy 44 (29), 15135-15145, 2019
582019
Size-and phase-dependent structure of copper (II) oxide nanoparticles
A Ahmed, P Elvati, A Violi
Rsc Advances 5 (44), 35033-35041, 2015
462015
Effect of potential truncations and shifts on the solid-liquid phase coexistence of Lennard-Jones fluids
A Ahmed, RJ Sadus
The Journal of chemical physics 133 (12), 2010
372010
Comparison of two simulation methods to compute solvation free energies and partition coefficients
L Yang, A Ahmed, SI Sandler
Journal of Computational Chemistry 34 (4), 284-293, 2013
362013
Hydration free energies of multifunctional nitroaromatic compounds
A Ahmed, SI Sandler
Journal of Chemical Theory and Computation 9 (6), 2774-2785, 2013
292013
Microscale determination of binary gas adsorption isotherms in MOFs
K Nath, A Ahmed, DJ Siegel, AJ Matzger
Journal of the American Chemical Society 144 (45), 20939-20946, 2022
262022
Solid-liquid phase equilibria of the Gaussian core model fluid
P Mausbach, A Ahmed, RJ Sadus
The Journal of chemical physics 131 (18), 2009
212009
Physicochemical properties of hazardous energetic compounds from molecular simulation
A Ahmed, SI Sandler
Journal of Chemical Theory and Computation 9 (5), 2389-2397, 2013
162013
Solvation free energies and hydration structure of N-methyl-p-nitroaniline
A Ahmed, SI Sandler
The Journal of Chemical Physics 136 (15), 2012
152012
Computational Identification and Experimental Demonstration of HighPerformance Methane Sorbents
K Nath, A Ahmed, DJ Siegel, AJ Matzger
Angewandte Chemie 134 (25), e202203575, 2022
142022
Strain-rate dependent shear viscosity of the Gaussian core model fluid
A Ahmed, P Mausbach, RJ Sadus
The Journal of chemical physics 131 (22), 2009
122009
Pressure and energy behavior of the Gaussian core model fluid under shear
A Ahmed, P Mausbach, RJ Sadus
Physical Review E 82 (1), 011201, 2010
102010
Temperature-dependent physicochemical properties and solvation thermodynamics of nitrotoluenes from solvation free energies
A Ahmed, SI Sandler
Journal of Chemical & Engineering Data 60 (1), 16-27, 2015
82015
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