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Kiran Mathew - Publications

Affiliations: 
2009-2015 Materials Science and Engineering Cornell University, Ithaca, NY, United States 
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19 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
2019 Mathew K, Kolluru VSC, Mula S, Steinmann SN, Hennig RG. Implicit self-consistent electrolyte model in plane-wave density-functional theory. The Journal of Chemical Physics. 151: 234101. PMID 31864239 DOI: 10.1063/1.5132354  0.61
2019 Goyal A, Mathew K, Hennig RG, Chernatynskiy A, Stanek CR, Murphy ST, Andersson DA, Phillpot SR, Uberuaga BP. The Conundrum of Relaxation Volumes in First-Principles Calculations of Charged Defects in UO2 Applied Sciences. 9: 5276. DOI: 10.3390/App9245276  0.579
2019 Ashton M, Trometer N, Mathew K, Suntivich J, Freysoldt C, Sinnott SB, Hennig RG. Correction to “Predicting the Electrochemical Synthesis of 2D Materials from First-Principles” The Journal of Physical Chemistry C. 123: 22690-22690. DOI: 10.1021/Acs.Jpcc.9B07353  0.608
2019 Ashton M, Trometer N, Mathew K, Suntivich J, Freysoldt C, Sinnott SB, Hennig RG. Predicting the Electrochemical Synthesis of 2D Materials from First Principles The Journal of Physical Chemistry C. 123: 3180-3187. DOI: 10.1021/Acs.Jpcc.8B10802  0.606
2018 Mathew K, Zheng C, Winston D, Chen C, Dozier A, Rehr JJ, Ong SP, Persson KA. High-throughput computational X-ray absorption spectroscopy. Scientific Data. 5: 180151. PMID 30063226 DOI: 10.1038/Sdata.2018.151  0.301
2017 Ditto J, Merrill DR, Mitchson G, Gabriel JJ, Mathew K, Hennig RG, Johnson DC, Medlin DL, Browning ND. Interface-Driven Structural Distortions and Composition Segregation in 2D Heterostructures. Angewandte Chemie (International Ed. in English). PMID 28879685 DOI: 10.1002/Anie.201707270  0.7
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  0.404
2016 Ashton M, Mathew K, Hennig RG, Sinnott SB. Predicted Surface Composition and Thermodynamic Stability of MXenes in Solution Journal of Physical Chemistry C. 120: 3550-3556. DOI: 10.1021/Acs.Jpcc.5B11887  0.591
2016 Mathew K, Singh AK, Gabriel JJ, Choudhary K, Sinnott SB, Davydov AV, Tavazza F, Hennig RG. MPInterfaces: A Materials Project based Python tool for high-throughput computational screening of interfacial systems Computational Materials Science. 122: 183-190. DOI: 10.1016/J.Commatsci.2016.05.020  0.622
2016 Choudhary K, Liang T, Mathew K, Revard B, Chernatynskiy A, Phillpot SR, Hennig RG, Sinnott SB. Dynamical properties of AlN nanostructures and heterogeneous interfaces predicted using COMB potentials Computational Materials Science. 113: 80-87. DOI: 10.1016/J.Commatsci.2015.11.025  0.704
2015 Singh AK, Mathew K, Zhuang HL, Hennig RG. Computational Screening of 2D Materials for Photocatalysis. The Journal of Physical Chemistry Letters. 6: 1087-98. PMID 26262874 DOI: 10.1021/Jz502646D  0.744
2015 Sakong S, Naderian M, Mathew K, Hennig RG, Groß A. Density functional theory study of the electrochemical interface between a Pt electrode and an aqueous electrolyte using an implicit solvent method. The Journal of Chemical Physics. 142: 234107. PMID 26093550 DOI: 10.1063/1.4922615  0.569
2015 Singh AK, Mathew K, Davydov AV, Hennig RG, Tavazza F. High throughput screening of substrates for synthesis and functionalization of 2D materials Proceedings of Spie - the International Society For Optical Engineering. 9553. DOI: 10.1117/12.2192866  0.707
2015 Choudhary K, Chernatynskiy A, Mathew K, Bucholz EW, Phillpot SR, Sinnott SB, Hennig RG. Computational discovery of lanthanide doped and Co-doped Y3Al5O12 for optoelectronic applications Applied Physics Letters. 107. DOI: 10.1063/1.4929434  0.59
2015 Singh AK, Mathew K, Zhuang HL, Hennig RG. Computational screening of 2D materials for photocatalysis Journal of Physical Chemistry Letters. 6: 1087-1098. DOI: 10.1021/jz502646d  0.713
2014 Ha DH, Caldwell AH, Ward MJ, Honrao S, Mathew K, Hovden R, Koker MK, Muller DA, Hennig RG, Robinson RD. Solid-solid phase transformations induced through cation exchange and strain in 2D heterostructured copper sulfide nanocrystals. Nano Letters. 14: 7090-9. PMID 25337657 DOI: 10.1021/Nl5035607  0.698
2014 Mathew K, Sundararaman R, Letchworth-Weaver K, Arias TA, Hennig RG. Implicit solvation model for density-functional study of nanocrystal surfaces and reaction pathways. The Journal of Chemical Physics. 140: 084106. PMID 24588147 DOI: 10.1063/1.4865107  0.623
2013 Fishman M, Zhuang HL, Mathew K, Dirschka W, Hennig RG. Accuracy of exchange-correlation functionals and effect of solvation on the surface energy of copper Physical Review B - Condensed Matter and Materials Physics. 87. DOI: 10.1103/Physrevb.87.245402  0.676
2013 Tipton WW, Bealing CR, Mathew K, Hennig RG. Structures, phase stabilities, and electrical potentials of Li-Si battery anode materials Physical Review B - Condensed Matter and Materials Physics. 87. DOI: 10.1103/Physrevb.87.184114  0.732
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