Muratahan Aykol - Publications

Affiliations: 
Toyota Research Institute 
Area:
computational materials science, DFT, batteries, machine learning

36 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2020 Wang C, Aoyagi K, Aykol M, Mueller T. Ionic Conduction through Reaction Products at the Electrolyte-Electrode Interface in All-Solid-State Li Batteries. Acs Applied Materials & Interfaces. PMID 33258370 DOI: 10.1021/acsami.0c17285  0.343
2020 Hegde VI, Aykol M, Kirklin S, Wolverton C. The phase stability network of all inorganic materials. Science Advances. 6: eaay5606. PMID 32158942 DOI: 10.1126/Sciadv.Aay5606  0.746
2020 Attia PM, Grover A, Jin N, Severson KA, Markov TM, Liao YH, Chen MH, Cheong B, Perkins N, Yang Z, Herring PK, Aykol M, Harris SJ, Braatz RD, Ermon S, et al. Closed-loop optimization of fast-charging protocols for batteries with machine learning. Nature. 578: 397-402. PMID 32076218 DOI: 10.1038/S41586-020-1994-5  0.309
2020 Montoya JH, Winther KT, Flores RA, Bligaard T, Hummelshøj JS, Aykol M. Autonomous intelligent agents for accelerated materials discovery Chemical Science. 11: 8517-8532. DOI: 10.1039/D0Sc01101K  0.381
2020 Rohr B, Stein HS, Guevarra D, Wang Y, Haber JA, Aykol M, Suram SK, Gregoire JM. Benchmarking the acceleration of materials discovery by sequential learning Chemical Science. 11: 2696-2706. DOI: 10.1039/C9Sc05999G  0.321
2020 Flores RA, Paolucci C, Winther KT, Jain A, Torres JAG, Aykol M, Montoya J, Nørskov JK, Bajdich M, Bligaard T. Active Learning Accelerated Discovery of Stable Iridium Oxide Polymorphs for the Oxygen Evolution Reaction Chemistry of Materials. 32: 5854-5863. DOI: 10.1021/Acs.Chemmater.0C01894  0.385
2020 Sivonxay E, Aykol M, Persson KA. The lithiation process and Li diffusion in amorphous SiO2 and Si from first-principles Electrochimica Acta. 331: 135344-135344. DOI: 10.1016/J.Electacta.2019.135344  0.327
2019 Aykol M, Hegde VI, Hung L, Suram S, Herring P, Wolverton C, Hummelshøj JS. Network analysis of synthesizable materials discovery. Nature Communications. 10: 2018. PMID 31043603 DOI: 10.1038/S41467-019-10030-5  0.571
2019 Aykol M, Kim S, Hegde VI, Kirklin S, Wolverton C. Computational evaluation of new lithium-3 garnets for lithium-ion battery applications as anodes, cathodes, and solid-state electrolytes Physical Review Materials. 3. DOI: 10.1103/Physrevmaterials.3.025402  0.751
2019 Severson KA, Attia PM, Jin N, Perkins N, Jiang B, Yang Z, Chen MH, Aykol M, Herring PK, Fraggedakis D, Bazant MZ, Harris SJ, Chueh WC, Braatz RD. Data-driven prediction of battery cycle life before capacity degradation Nature Energy. 4: 383-391. DOI: 10.1038/S41560-019-0356-8  0.318
2019 Aykol M, Hummelshøj JS, Anapolsky A, Aoyagi K, Bazant MZ, Bligaard T, Braatz RD, Broderick S, Cogswell D, Dagdelen J, Drisdell W, Garcia E, Garikipati K, Gavini V, Gent WE, et al. The Materials Research Platform: Defining the Requirements from User Stories Matter. 1: 1433-1438. DOI: 10.1016/j.matt.2019.10.024  0.419
2018 Shin Y, Kan WH, Aykol M, Papp JK, McCloskey BD, Chen G, Persson KA. Alleviating oxygen evolution from Li-excess oxide materials through theory-guided surface protection. Nature Communications. 9: 4597. PMID 30389938 DOI: 10.1038/S41467-018-07080-6  0.42
2018 Aykol M, Dwaraknath SS, Sun W, Persson KA. Thermodynamic limit for synthesis of metastable inorganic materials. Science Advances. 4: eaaq0148. PMID 29725618 DOI: 10.1126/Sciadv.Aaq0148  0.393
2018 Ward L, Aykol M, Blaiszik B, Foster I, Meredig B, Saal J, Suram S. Strategies for accelerating the adoption of materials informatics Mrs Bulletin. 43: 683-689. DOI: 10.1557/Mrs.2018.204  0.707
2018 Bassman L, Rajak P, Kalia RK, Nakano A, Sha F, Aykol M, Huck P, Persson K, Sun J, Singh DJ, Vashishta P. Efficient Discovery of Optimal N-Layered TMDC Hetero-Structures Mrs Advances. 3: 397-402. DOI: 10.1557/Adv.2018.260  0.32
2018 Yao Z, Kim S, Michel K, Zhang Y, Aykol M, Wolverton C. Stability and conductivity of cation- and anion-substituted LiBH4 -based solid-state electrolytes Physical Review Materials. 2. DOI: 10.1103/Physrevmaterials.2.065402  0.663
2018 Tabor DP, Roch LM, Saikin SK, Kreisbeck C, Sheberla D, Montoya JH, Dwaraknath S, Aykol M, Ortiz C, Tribukait H, Amador-Bedolla C, Brabec CJ, Maruyama B, Persson KA, Aspuru-Guzik A. Accelerating the discovery of materials for clean energy in the era of smart automation Nature Reviews Materials. 3: 5-20. DOI: 10.1038/S41578-018-0005-Z  0.37
2018 Snydacker DH, Hegde VI, Aykol M, Wolverton C. Computational Discovery of Li–M–O Ion Exchange Materials for Lithium Extraction from Brines Chemistry of Materials. 30: 6961-6968. DOI: 10.1021/Acs.Chemmater.7B03509  0.616
2018 Ward L, O'Keeffe SC, Stevick J, Jelbert GR, Aykol M, Wolverton C. A machine learning approach for engineering bulk metallic glass alloys Acta Materialia. 159: 102-111. DOI: 10.1016/J.Actamat.2018.08.002  0.526
2017 Aykol M, Doak JW, Wolverton C. Phosphorus allotropes: Stability of black versus red phosphorus re-examined by means of the van der Waals inclusive density functional method Physical Review B. 95. DOI: 10.1103/Physrevb.95.214115  0.46
2017 Kim S, Aykol M, Hegde VI, Lu Z, Kirklin S, Croy JR, Thackeray MM, Wolverton C. Material design of high-capacity Li-rich layered-oxide electrodes: Li2MnO3 and beyond Energy & Environmental Science. 10: 2201-2211. DOI: 10.1039/C7Ee01782K  0.775
2017 Yao Z, Kim S, Aykol M, Li Q, Wu J, He J, Wolverton C. Revealing the Conversion Mechanism of Transition Metal Oxide Electrodes during Lithiation from First-Principles Chemistry of Materials. 29: 9011-9022. DOI: 10.1021/Acs.Chemmater.7B02058  0.704
2017 Mathew K, Montoya JH, Faghaninia A, Dwarakanath S, Aykol M, Tang H, Chu I, Smidt T, Bocklund B, Horton M, Dagdelen J, Wood B, Liu Z, Neaton J, Ong SP, et al. Atomate: A high-level interface to generate, execute, and analyze computational materials science workflows Computational Materials Science. 139: 140-152. DOI: 10.1016/J.Commatsci.2017.07.030  0.375
2016 Aykol M, Kim S, Hegde VI, Snydacker D, Lu Z, Hao S, Kirklin S, Morgan D, Wolverton C. High-throughput computational design of cathode coatings for Li-ion batteries. Nature Communications. 7: 13779. PMID 27966537 DOI: 10.1038/Ncomms13779  0.775
2016 Snydacker DH, Aykol M, Kirklin S, Wolverton C. Lithium-Ion Cathode/Coating Pairs for Transition Metal Containment Journal of the Electrochemical Society. 163: A2054-A2064. DOI: 10.1149/2.1101609Jes  0.741
2015 Kim S, Noh JK, Aykol M, Lu Z, Kim H, Choi W, Kim C, Chung KY, Wolverton C, Cho BW. Layered-Layered-Spinel Cathode Materials Prepared by a High-Energy Ball-Milling Process for Lithium-ion Batteries. Acs Applied Materials & Interfaces. PMID 26645115 DOI: 10.1021/Acsami.5B08906  0.626
2015 Yu Y, Aykol M, Wolverton C. Reaction thermochemistry of metal sulfides with GGA and GGA+U calculations Physical Review B - Condensed Matter and Materials Physics. 92. DOI: 10.1103/Physrevb.92.195118  0.463
2015 Kim S, Aykol M, Wolverton C. Surface phase diagram and stability of (001) and (111) LiM n2 O4 spinel oxides Physical Review B - Condensed Matter and Materials Physics. 92. DOI: 10.1103/Physrevb.92.115411  0.497
2015 Kirklin S, Saal JE, Meredig B, Thompson A, Doak JW, Aykol M, Rühl S, Wolverton C. The Open Quantum Materials Database (OQMD): assessing the accuracy of DFT formation energies Npj Computational Materials. 1. DOI: 10.1038/npjcompumats.2015.10  0.724
2015 Aykol M, Kim S, Wolverton C. Van der Waals Interactions in Layered Lithium Cobalt Oxides Journal of Physical Chemistry C. 119: 19053-19058. DOI: 10.1021/Acs.Jpcc.5B06240  0.573
2015 Jaber-Ansari L, Puntambekar KP, Kim S, Aykol M, Luo L, Wu J, Myers BD, Iddir H, Russell JT, Saldaña SJ, Kumar R, Thackeray MM, Curtiss LA, Dravid VP, Wolverton C, et al. Suppressing Manganese Dissolution from Lithium Manganese Oxide Spinel Cathodes with Single-Layer Graphene Advanced Energy Materials. DOI: 10.1002/Aenm.201500646  0.574
2014 Cho JH, Aykol M, Kim S, Ha JH, Wolverton C, Chung KY, Kim KB, Cho BW. Controlling the intercalation chemistry to design high-performance dual-salt hybrid rechargeable batteries. Journal of the American Chemical Society. 136: 16116-9. PMID 25364815 DOI: 10.1021/Ja508463Z  0.591
2014 Aykol M, Wolverton C. Publisher's Note: Local environment dependentGGA+Umethod for accurate thermochemistry of transition metal compounds [Phys. Rev. B90, 115105 (2014)] Physical Review B. 90. DOI: 10.1103/Physrevb.90.119904  0.456
2014 Aykol M, Wolverton C. Local environment dependent GGA+U method for accurate thermochemistry of transition metal compounds Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.115105  0.46
2014 Aykol M, Kirklin S, Wolverton C. Thermodynamic aspects of cathode coatings for lithium-ion batteries Advanced Energy Materials. 4. DOI: 10.1002/Aenm.201400690  0.767
2013 Saal JE, Kirklin S, Aykol M, Meredig B, Wolverton C. Materials design and discovery with high-throughput density functional theory: The open quantum materials database (OQMD) Jom. 65: 1501-1509. DOI: 10.1007/S11837-013-0755-4  0.762
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