Theo dõi
Shyam Dwaraknath
Shyam Dwaraknath
None
Email được xác minh tại getcruise.com
Tiêu đề
Trích dẫn bởi
Trích dẫn bởi
Năm
On the use of SRIM for computing radiation damage exposure
RE Stoller, MB Toloczko, GS Was, AG Certain, S Dwaraknath, FA Garner
Nuclear instruments and methods in physics research section B: beam …, 2013
15752013
Accelerating the discovery of materials for clean energy in the era of smart automation
DP Tabor, LM Roch, SK Saikin, C Kreisbeck, D Sheberla, JH Montoya, ...
Nature reviews materials 3 (5), 5-20, 2018
7472018
Atomate: A high-level interface to generate, execute, and analyze computational materials science workflows
K Mathew, JH Montoya, A Faghaninia, S Dwarakanath, M Aykol, H Tang, ...
Computational Materials Science 139, 140-152, 2017
3802017
Thermodynamic limit for synthesis of metastable inorganic materials
M Aykol, SS Dwaraknath, W Sun, KA Persson
Science advances 4 (4), eaaq0148, 2018
3542018
High-throughput density-functional perturbation theory phonons for inorganic materials
G Petretto, S Dwaraknath, H PC Miranda, D Winston, M Giantomassi, ...
Scientific data 5 (1), 1-12, 2018
1892018
A framework for quantifying uncertainty in DFT energy corrections
A Wang, R Kingsbury, M McDermott, M Horton, A Jain, SP Ong, ...
Scientific reports 11 (1), 15496, 2021
1262021
Computational approach for epitaxial polymorph stabilization through substrate selection
H Ding, SS Dwaraknath, L Garten, P Ndione, D Ginley, KA Persson
ACS applied materials & interfaces 8 (20), 13086-13093, 2016
1232016
OPTIMADE, an API for exchanging materials data
CW Andersen, R Armiento, E Blokhin, GJ Conduit, S Dwaraknath, ...
Scientific data 8 (1), 217, 2021
1082021
The existence and impact of persistent ferroelectric domains in MAPbI3
LM Garten, DT Moore, SU Nanayakkara, S Dwaraknath, P Schulz, ...
Science advances 5 (1), eaas9311, 2019
992019
Toward a mechanistic model of solid–electrolyte interphase formation and evolution in lithium-ion batteries
EWC Spotte-Smith, RL Kam, D Barter, X Xie, T Hou, S Dwaraknath, ...
ACS Energy Letters 7 (4), 1446-1453, 2022
932022
A graph-based network for predicting chemical reaction pathways in solid-state materials synthesis
MJ McDermott, SS Dwaraknath, KA Persson
Nature communications 12 (1), 3097, 2021
922021
BonDNet: a graph neural network for the prediction of bond dissociation energies for charged molecules
M Wen, SM Blau, EWC Spotte-Smith, S Dwaraknath, KA Persson
Chemical science 12 (5), 1858-1868, 2021
882021
Performance comparison of and SCAN metaGGA density functionals for solid materials via an automated, high-throughput computational workflow
R Kingsbury, AS Gupta, CJ Bartel, JM Munro, S Dwaraknath, M Horton, ...
Physical Review Materials 6 (1), 013801, 2022
842022
The materials project: Accelerating materials design through theory-driven data and tools
A Jain, J Montoya, S Dwaraknath, NER Zimmermann, J Dagdelen, ...
Handbook of Materials Modeling: Methods: Theory and Modeling, 1751-1784, 2020
772020
Assessing high-throughput descriptors for prediction of transparent conductors
R Woods-Robinson, D Broberg, A Faghaninia, A Jain, SS Dwaraknath, ...
Chemistry of Materials 30 (22), 8375-8389, 2018
772018
An improved symmetry-based approach to reciprocal space path selection in band structure calculations
JM Munro, K Latimer, MK Horton, S Dwaraknath, KA Persson
npj Computational Materials 6 (1), 112, 2020
752020
Rapid generation of optimal generalized Monkhorst-Pack grids
Y Wang, P Wisesa, A Balasubramanian, S Dwaraknath, T Mueller
Computational Materials Science 187, 110100, 2021
742021
Multiple ion beam irradiation for the study of radiation damage in materials
S Taller, D Woodley, E Getto, AM Monterrosa, Z Jiao, O Toader, F Naab, ...
Nuclear Instruments and Methods in Physics Research Section B: Beam …, 2017
732017
Propnet: a knowledge graph for materials science
D Mrdjenovich, MK Horton, JH Montoya, CM Legaspi, S Dwaraknath, ...
Matter 2 (2), 464-480, 2020
622020
Evaluation of thermodynamic equations of state across chemistry and structure in the materials project
K Latimer, S Dwaraknath, K Mathew, D Winston, KA Persson
npj Computational Materials 4 (1), 40, 2018
602018
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