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Ali Malek
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Non-monotonic surface charging behavior of platinum: a paradigm change
J Huang, A Malek, J Zhang, MH Eikerling
The Journal of Physical Chemistry C 120 (25), 13587-13595, 2016
1492016
Fundamental studies of aluminum corrosion in acidic and basic environments: Theoretical predictions and experimental observations
M Lashgari, AM Malek
Electrochimica Acta 55 (18), 5253-5257, 2010
1032010
How theory and simulation can drive fuel cell electrocatalysis
MJ Eslamibidgoli, J Huang, T Kadyk, A Malek, M Eikerling
Nano Energy 29, 334-361, 2016
892016
Revisiting the chemical reactivity indices as the state function derivatives. The role of classical chemical hardness
A Malek, R Balawender
The Journal of Chemical Physics 142 (5), 2015
412015
Synthesis and structure–property relationships of novel thiazole‐containing poly (amide imide) s with high refractive indices and low birefringences
A Javadi, A Shockravi, A Rafieimanesh, A Malek, S Ando
polymer international 64 (4), 486-495, 2015
372015
High refractive index and low-birefringence polyamides containing thiazole and naphthalene units
A Javadi, Z Najjar, S Bahadori, V Vatanpour, A Malek, E Abouzari-Lotf, ...
RSC advances 5 (111), 91670-91682, 2015
352015
Horton 2.0. 1
T Verstraelen, P Tecmer, F Heidar-Zadeh, CE González-Espinoza, ...
URL http://theochem. github. com/horton, 2015
332015
Nitro-substituted polyamides: A new class of transparent and highly refractive materials
A Javadi, A Shockravi, M Koohgard, A Malek, FA Shourkaei, S Ando
European Polymer Journal 66, 328-341, 2015
322015
Solution processable polyamides containing thiazole units and thioether linkages with high optical transparency, high refractive index, and low birefringence
A Javadi, A Shockravi, M Kamali, A Rafieimanesh, AM Malek
Journal of Polymer Science Part A: Polymer Chemistry 51 (16), 3505-3515, 2013
302013
Molecular modeling of the proton density distribution in a water-filled slab-like nanopore bounded by Pt oxide and ionomer
A Nouri-Khorasani, K Malek, A Malek, T Mashio, DP Wilkinson, ...
Catalysis Today 262, 133-140, 2016
292016
Chemisorbed oxygen at Pt (111): a DFT study of structural and electronic surface properties
A Malek, MH Eikerling
Electrocatalysis 9, 370-379, 2018
262018
Strategies in cell design and operation for the electrosynthesis of ammonia: status and prospects
W Bi, N Shaigan, A Malek, K Fatih, E Gyenge, DP Wilkinson
Energy & Environmental Science 15 (6), 2259-2287, 2022
192022
A Data-Driven Framework for the Accelerated Discovery of CO2 Reduction Electrocatalysts
A Malek, Q Wang, S Baumann, O Guillon, M Eikerling, K Malek
Frontiers in energy research 9, 609070, 2021
162021
Horton 2.0. 0, 2015
T Verstraelen, K Boguslawski, P Tecmer, F Heidar-Zadeh, M Chan, ...
16*2015
Aquivion ionomer in mixed alcohol–water solution: insights from multiscale molecular modeling
A Malek, E Sadeghi, J Jankovic, M Eikerling, K Malek
The Journal of Physical Chemistry C 124 (6), 3429-3438, 2020
142020
Virtual Materials Intelligence for Design and Discovery of Advanced Electrocatalysts
A Malek, MJ Eslamibidgoli, M Mokhtari, Q Wang, MH Eikerling, K Malek
ChemPhysChem, 2019
122019
Highly refractive thiazole-containing polyimides: a structural property comparison
A Javadi, A Shockravi, FA Shourkaei, M Koohgard, A Malek
Journal of Polymer Research 25, 1-13, 2018
62018
Correction to “Non-monotonic Surface Charging Behavior of Platinum: A Paradigm Change”
J Huang, A Malek, J Zhang, MH Eikerling
The Journal of Physical Chemistry C 121 (46), 26140-26140, 2017
32017
Testing exchange–correlation functionals at fractional electron numbers
A Malek, D Peng, W Yang, R Balawender, A Holas
Theoretical Chemistry Accounts 133, 1-7, 2014
22014
A Study on Effect of Ionomer Content on Catalyst Ink Property and PEM Water Electrolyzer Performance
C Song, K Tsay, E Fisher, N Sheibley, N Shaigan, A Malek, K Fatih
Electrochemical Society Meeting Abstracts 243, 2110-2110, 2023
12023
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