Publications
Selected peer-reviewed publications by Dr. A. C. M. Padilha:
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2023- Ordered vacancy compounds: the case of the Mangéli phases of TiO2, Metal Oxide Defects, 533-565, DOI: 10.1016/B978-0-323-85588-4.00014-3
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2021- Cryo-EM structure of the mature and infective Mayaro virus at 4.4 Å resolution reveals new features of arthritogenic alphaviruses, Nature Communications, 12, 3038, DOI: 10.1038/s41467-021-23400-9
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2021- Discovery of Higher-Order Topological Insulators using the Spin Hall Conductivity as a Topology Signature, npj Computational Materials, 7, Article number: 49, DOI: 10.1038/s41524-021-00518-4
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2020- Ambipolar Resistive Switching in Ultrathin Surface-Supported Metal-Organic Framework Vertical Heterojunction, Nano Letters, 20, 2, 1080–1088, DOI: 10.1021/acs.nanolett.9b04355
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2020- Electronic mechanism for resistive switching in metal/insulator/metal nanodevices, Journal of Physics D: Applied Physics, 53, 295302, DOI: 10.1088/1361-6463/ab7a58
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2019- Ab Initio Simulations and Materials Chemistry in the Age of Big Data, Journal of Chemical Information and Modeling, 60, 2, 452–459, DOI: 10.1021/acs.jcim.9b00781
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2019- First principles investigation of Y2O3-doped HfO2, Journal of Applied Physics, 126:8, DOI: 10.1063/1.5110669
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2019- Theoretical and Experimental Investigation of 2D Hematite, The Journal of Physical Chemistry C, 123 (26), 16359-16365, DOI: 10.1021/acs.jpcc.9b01046
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2019- Magnetic ordering contribution on diffusion process forming hollow materials, Solid State Ionics, 339, 115000, DOI: 10.1016/j.ssi.2019.115000
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2019- From DFT to machine learning: recent approaches to materials science–a review, Journal of Physics: Materials, 2 032001, DOI: 10.1088/2515-7639/ab084b
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2018- Structure and properties of a model conductive filament/host oxide interface in HfO2-based ReRAM, Physical Review Materials, 2, 045001, DOI: 10.1103/PhysRevMaterials.2.045001
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2016- Charge storage in oxygen deficient phases of TiO2: defect Physics without defects, Scientific Reports, 6:28871, DOI: 10.1038/srep28871
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2016- A search for the ground state structure and the phase stability of tantalum pentoxide, Journal of Physics: Condensed Matter, 28, 035801, DOI: 10.1088/0953-8984/28/3/035801
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2015- DTF+U Simulation of the Ti4O7-TiO2 Interface, Physical Review Applied, 3, 024009, DOI: 10.1103/PhysRevApplied.3.024009
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2014- TinO2n−1 Magnéli phases studied using density functional theory, Physical Review B, 90, 035213, DOI: 10.1103/PhysRevB.90.035213
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2008- Oxidation of anilinium ions intercalated in montmorillonite clay by electrochemical route, Colloids and Surfaces A: Physicochemical and Engineering Aspects, 318, 245–253, DOI: 10.1016/j.colsurfa.2007.12.042
For additional information, access my Google Scholar profile.