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Binay Prasai
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Properties of amorphous and crystalline titanium dioxide from first principles
B Prasai, B Cai, MK Underwood, JP Lewis, DA Drabold
Journal of materials science 47 (21), 7515-7521, 2012
2472012
Atomic-structural synergy for catalytic CO oxidation over palladium–nickel nanoalloys
S Shan, V Petkov, L Yang, J Luo, P Joseph, D Mayzel, B Prasai, L Wang, ...
Journal of the American Chemical Society 136 (19), 7140-7151, 2014
1132014
Catalytic activity of bimetallic catalysts highly sensitive to the atomic composition and phase structure at the nanoscale
S Shan, V Petkov, B Prasai, J Wu, P Joseph, Z Skeete, E Kim, D Mott, ...
Nanoscale 7 (45), 18936-18948, 2015
652015
Composition–structure–activity relationships for palladium-alloyed nanocatalysts in oxygen reduction reaction: an ex-situ/in-situ high energy X-ray diffraction study
J Wu, S Shan, V Petkov, B Prasai, H Cronk, P Joseph, J Luo, CJ Zhong
ACS Catalysis 5 (9), 5317-5327, 2015
542015
Solving the nanostructure problem: exemplified on metallic alloy nanoparticles
V Petkov, B Prasai, Y Ren, S Shan, J Luo, P Joseph, CJ Zhong
Nanoscale 6 (17), 10048-10061, 2014
412014
Direct ab-initio molecular dynamic study of ultrafast phase change in Ag-alloyed Ge2Sb2Te5
B Prasai, G Chen, DA Drabold
Applied Physics Letters 102 (4), 2013
322013
On the road to metallic nanoparticles by rational design: bridging the gap between atomic-level theoretical modeling and reality by total scattering experiments
B Prasai, AR Wilson, BJ Wiley, Y Ren, V Petkov
Nanoscale 7 (42), 17902-17922, 2015
312015
Structural dynamics and activity of nanocatalysts inside fuel cells by in operando atomic pair distribution studies
V Petkov, B Prasai, S Shan, Y Ren, J Wu, H Cronk, J Luo, CJ Zhong
Nanoscale 8 (20), 10749-10767, 2016
282016
Ab initio simulation of solid electrolyte materials in liquid and glassy phases
B Prasai, DA Drabold
Physical Review B 83 (9), 094202, 2011
242011
Synthesis-atomic structure-properties relationships in metallic nanoparticles by total scattering experiments and 3D computer simulations: case of Pt–Ru nanoalloy catalysts
B Prasai, Y Ren, S Shan, Y Zhao, H Cronk, J Luo, CJ Zhong, V Petkov
Nanoscale 7 (17), 8122-8134, 2015
23*2015
Surface atomic structure and functionality of metallic nanoparticles: a case study of Au–Pd nanoalloy catalysts
V Petkov, B Prasai, S Shastri, JW Kim, S Shan, HR Kareem, J Luo, ...
The Journal of Physical Chemistry C 121 (14), 7854-7866, 2017
222017
Composition–Structure–Activity Correlation of Platinum–Ruthenium Nanoalloy Catalysts for Ethanol Oxidation Reaction
Y Zhao, Y Maswadeh, S Shan, H Cronk, Z Skeete, B Prasai, J Luo, ...
The Journal of Physical Chemistry C 121 (32), 17077-17087, 2017
182017
Charting the relationship between phase type-surface area-interactions between the constituent atoms and oxygen reduction activity of Pd–Cu nanocatalysts inside fuel cells by …
Y Maswadeh, S Shan, B Prasai, Y Zhao, ZH Xie, Z Wu, J Luo, Y Ren, ...
Journal of materials chemistry A 5 (16), 7355-7365, 2017
172017
Ensemble averaged structure–function relationship for nanocrystals: effective superparamagnetic Fe clusters with catalytically active Pt skin
V Petkov, B Prasai, S Shastri, HU Park, YU Kwon, V Skumryev
Nanoscale 9 (40), 15505-15514, 2017
162017
3D Atomic arrangement at functional interfaces inside nanoparticles by resonant high-energy X-ray diffraction
V Petkov, B Prasai, S Shastri, TY Chen
ACS Applied Materials & Interfaces 7 (41), 23265-23277, 2015
122015
Ab-initio Calculation of Structural and Electrical Properties of Amorphous TiO2
B Prasai, B Cai, DA Drabold, MK Underwood, JP Lewis
Glass and Optical Materials, MS&T Publications Department, 2011
72011
Evolution of surface catalytic sites on thermochemically-tuned gold–palladium nanoalloys
H Kareem, S Shan, F Lin, J Li, Z Wu, B Prasai, CP O'Brien, IC Lee, ...
Nanoscale 10 (8), 3849-3862, 2018
62018
Atomistic origin of rapid crystallization of Ag‐doped Ge–S b–T e alloys: A joint experimental and theoretical study
B Prasai, ME Kordesch, DA Drabold, G Chen
physica status solidi (b) 250 (9), 1785-1790, 2013
52013
High‐throughput evaluation in nitrogen doping of amorphous titanium dioxide
BJ Haycock, G Lander, MK Rice, K Prasai, B Prasai, DA Drabold, ...
physica status solidi (b) 251 (6), 1225-1230, 2014
42014
Atomistic Simulations of Flash Memory Materials Based on Chalcogenide Glasses
B Cai, B Prasai, DA Drabold
Flash Memories, 2011
32011
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