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Shree Ram Acharya
Shree Ram Acharya
Leidos, National Energy Technology Laboratory
Adresse e-mail validée de leidos.com
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Design of tough adhesive from commodity thermoplastics through dynamic crosslinking
MA Rahman, C Bowland, S Ge, SR Acharya, S Kim, VR Cooper, XC Chen, ...
Science advances 7 (42), eabk2451, 2021
672021
Splitting mono-and dibranched alkane isomers by a robust aluminum-based metal–organic framework material with optimal pore dimensions
L Yu, X Dong, Q Gong, SR Acharya, Y Lin, H Wang, Y Han, T Thonhauser, ...
Journal of the American Chemical Society 142 (15), 6925-6929, 2020
552020
Ultrafast electron correlations and memory effects at work: Femtosecond demagnetization in Ni
SR Acharya, V Turkowski, GP Zhang, TS Rahman
Physical Review Letters 125 (1), 017202, 2020
382020
Electron thermalization and relaxation in laser-heated nickel by few-femtosecond core-level transient absorption spectroscopy
HT Chang, A Guggenmos, SK Cushing, Y Cui, NU Din, SR Acharya, ...
Physical Review B 103 (6), 064305, 2021
302021
High Catalytic Activity of Pd1/ZnO(101̅0) toward Methanol Partial Oxidation: A DFT+KMC Study
TB Rawal, SR Acharya, S Hong, D Le, Y Tang, FF Tao, TS Rahman
ACS Catalysis 8 (6), 5553-5569, 2018
252018
Diffusion of small Cu islands on the Ni (111) surface: A self-learning kinetic Monte Carlo study
SR Acharya, SI Shah, TS Rahman
Surface Science 662, 42-58, 2017
172017
Identifying the gate-opening mechanism in the flexible metal–organic framework UTSA-300
SR Acharya, A Elias, K Tan, S Jensen, RB Lin, B Chen, MD Gross, ...
Inorganic Chemistry 61 (12), 5025-5032, 2022
92022
Atomic-Scale Structure and Catalysis on Positively Charged Bimetallic Sites for Generation of H2
Y Tang, S Zhang, TB Rawal, L Nguyen, Y Iwasawa, SR Acharya, J Liu, ...
Nano Letters 20 (9), 6255-6262, 2020
92020
Variance induced decoupling of spin, lattice, and charge ordering in perovskite nickelates
AR Mazza, SR Acharya, P Wąsik, J Lapano, J Li, BL Musico, V Keppens, ...
Physical Review Research 5 (1), 013008, 2023
72023
Role of Pairwise Reactions on the Synthesis of Li0.3La0.57TiO3 and the Resulting Structure–Property Correlations
TF Malkowski, RL Sacci, RD McAuliffe, SR Acharya, VR Cooper, ...
Inorganic Chemistry 60 (19), 14831-14843, 2021
72021
Towards TDDFT for Strongly Correlated Materials
SR Acharya, V Turkowski, TS Rahman
Computation 4 (3), 34, 2016
62016
Toward multiscale modeling of thin-film growth processes using SLKMC
SR Acharya, TS Rahman
Journal of Materials Research 33 (6), 709-719, 2018
52018
Unintended consequence of topochemical reduction of to : Design of infinite layered oxides
T Ferreira, SR Acharya, YW Li, DS Parker, AS Sefat, VR Cooper
Physical Review Materials 5 (12), 123401, 2021
22021
Ba₁₋ ₓSrₓFeO₃₋ ᵧ as an Improved Oxygen Carrier for Chemical Looping Air Separation: A Computational and Experimental Study
SR Acharya, E Popczun, HP Paudel, S Natesakhawat, Y Duan, J Lekse
National Energy Technology Laboratory (NETL), Pittsburgh, PA, Morgantown, WV …, 2024
2024
SrₓBa₁₋ ₓFeO₃₋ ᵧ as an Improved Oxygen Carrier for Chemical Looping Air Separation: A Computational and Experimental Study
SR Acharya, EJ Popczun, HP Paudel, S Natesakhawat, Y Duan, ...
Bulletin of the American Physical Society, 2024
2024
Tuning stability, reducibility, and properties of AA'BO3-Δ perovskites by cations composition: A first-principles study
SR Acharya, V Cooper
APS March Meeting Abstracts 2022, A53. 010, 2022
2022
Computational design of layered-oxide materials
SR Acharya, T Ferreira, A Sefat, V Cooper
APS March Meeting Abstracts 2021, X37. 010, 2021
2021
Dominant contributions to the apparent activation energy in two-dimensional submonolayer growth: comparison between Cu/Ni (111) and Ni/Cu (111)
J Alberdi-Rodriguez, SR Acharya, TS Rahman, A Arnau, MA Gosálvez
Journal of Physics: Condensed Matter 32 (44), 445002, 2020
2020
CCDC 1970606: Experimental Crystal Structure Determination: catena-[bis (mu-4, 4', 4''-[benzene-1, 3, 5-triyltris (oxy)] tribenzoato)-tris (mu-hydroxy)-tri-aluminium (iii) 3 …
L Yu, X Dong, Q Gong, SR Acharya, Y Lin, H Wang, Y Han, T Thonhauser, ...
Cambridge Crystallographic Data Centre, 2020
2020
Geometric models and electronic structure of Pb overlayers on Ge (111): a first-principles study
A Childs, SR Acharya, D Le, C Fong, S Chiang, T Rahman
Bulletin of the American Physical Society 65, 2020
2020
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