The Journal of Physical Chemistry Letters, 2021, 12, 7964–7971.
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From Frequency Domain to Time Transient Methods for Halide Perovskite Solar Cells: The Connections of IMPS, IMVS, TPC, and TPV.
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The Journal of Physical Chemistry Letters, 2021, 12, 7840–7845.
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Unique Curve for the Radiative Photovoltage Deficit Caused by the Urbach Tail.
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Energy & Environmental Science, 2021,
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Two Birds with One Stone: Dual Grain-Boundary and Interface Passivation Enables > 22% Efficient Inverted Methylammonium-Free Perovskite Solar Cells.
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ACS Physical Chemistry Au, 2021, 1, 25-44.
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Theory of Hysteresis in Halide Perovskites by Integration of the Equivalent Circuit.
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ACS Applied Materials and Interfaces, 2021, 13, 35617–35624.
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Mobile Ion-Driven Modulation of Electronic Conductivity Explains Long-Timescale Electrical Response in Lead Iodide Perovskite Thick Pellets.
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Computational Studies Suggest Promiscuous Candida antarctica Lipase B as an Environmentally Friendly Alternative for the Production of Epoxides.
ACS Catalysis, 2021, 11, 8635–8644.
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Combined Theoretical and Experimental Study to Unravel the Differences in Promiscuous Amidase Activity of Two Nonhomologous Enzymes.
Advanced Science, 2021, 2100120.
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High Shunt Resistance SnO2-PbO Electron Transport Layer for Perovskite Solar Cells Used in Low Lighting Applications.
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The Journal of Physical Chemistry C, 2021, 125, 15737−15741.
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Locating the Frequency of Turnover in Thin-Film Diffusion Impedance.
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ACS Applied Energy Materials, 2021, 4, 5615–5624.
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High-Efficiency Lead-Free Wide Band Gap Perovskite Solar Cells via Guanidinium Bromide Incorporation.
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ACS Applied Nano Materials, 2021, 4 (6), 6170−6177.
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Inhomogeneous Broadening of Photoluminescence Spectra and Kinetics of Nanometer-Thick (Phenethylammonium)2PbI4 Perovskite Thin Films: Implications for Optoelectronics.
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Advanced Optical Materials, 2021, 9 (19), 2100807 (1-11).
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Recycled Photons Traveling Several Millimeters in Waveguides Based on CsPbBr3 Perovskite Nanocrystals.
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Quantifying the Absorption Onset in the Quantum Efficiency of Emerging Photovoltaic Devices.
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Advanced Electronic Materials, 2021, 7, 2001165.
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Characterization of Aerosol Deposited Cesium Lead Tribromide Perovskite Films on Interdigited ITO Electrodes.
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Angewandte Chemie International Edition, 2021, 60, 15412-15417.
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Ion Mobility Mass Spectrometry Uncovers Guest-Induced Distortions in a Supramolecular Organometallic Metallosquare.
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Chemistry - A European Journal, 2021, 27, 9661-9665.
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Shape-Adaptability and Redox-Switching Properties of a Di-Gold Metallotweezer.
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QM/MM Study of the Enzymatic Biodegradation Mechanism of Polyethylene Terephthalate.
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PROTEINS: Structure, Function and Bioinformatics, 2021, 1-13.
da Costa, C.Henrique S.; Santos, A.M. dos; Alves, C.audioNahum; Martí, S.; Moliner, V.; Santana, K.; Lameira, J.
Assessment of the PETase conformational changes induced by poly(ethylene terephthalate) binding.
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ACS Applied Bio Materials, 2021, 4, 935-944.
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Two-Component Peptidic Molecular Gels for Topical Drug Delivery of Naproxen.
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ACS Catalysis, 2021, 11, 8211–8225.
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Enzymatic Δ1-Dehydrogenation of 3-Ketosteroids—Reconciliation of Kinetic Isotope Effects with the Reaction Mechanism.
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ACS Nano, 2021, 15 (7), 10775–10981.
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State of the Art and Prospects for Halide Perovskite Nanocrystals.
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ACS Energy Letters, 2021, 6, 2248–2255.
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Extracting in Situ Charge Carrier Diffusion Parameters in Perovskite Solar Cells with Light Modulated Techniques.
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QMCube (QM3): An all-purpose suite for multiscale QM/MM calculations.
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A QM/MM study on the origin of retro-aldolase activity of a catalytic antibody.
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Mechanism of Inhibition of SARS-CoV-2 Mpro by N3 Peptidyl Michael Acceptor Explained by QM/MM Simulations and Design of New Derivatives with Tunable Chemical Reactivity.
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Journal of Materials Chemistry A, 2021,
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Self-Supported Ultra-Active NiO-Based Electrocatalysts for Oxygen Evolution Reaction by Solution Combustion.
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ACS Applied Energy Materials, 2021,
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Solution-processed Ni-based nanocomposite electrocatalysts: An approach to highly efficient Electrochemical Water Splitting.
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Comparison of Perovskite Solar Cells with other Photovoltaics Technologies from the Point of View of Life Cycle Assessment.
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Applied Surface Science, 2021, 551, 149387.
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Preparation of nanoscale inorganic CsPbIxBr3-x perovskite photosensitizers on the surface of mesoporous TiO2 film for solid-state sensitized solar cells.
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Advanced Energy & Sustainability Research, 2021, 2, 2000086.
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High-Efficiency Digital Inkjet-Printed Non-Fullerene Polymer Blends Using Non-Halogenated Solvents.
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Physical Chemistry Chemical Physics, 2021, 23, 4646-4657.
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A first-principles study of the stability, electronic structure, and optical properties of halide double perovskite Rb2Sn1xTexI6 for solar cell applications.
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Journal of Catalysis, 2021, 394, 113 - 120.
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Ligand effects in the stabilization of Gold nanoparticles anchored on the surface of graphene: Implications in catalysis..
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Applied Physics Letters, 2021, 118, 073501.
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Spectral properties of the dynamic state transition in metal halide perovskite-based memristor exhibiting negative capacitance.
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High Optical Performance of Cyan-Emissive CsPbBr3 Perovskite Quantum Dots Embedded in Molecular Organogels.
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ACS Applied Energy Materials, 2021, 4, 1078−1084.
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Interfacial Passivation of Perovskite Solar Cells by Reactive Ion Scavengers.
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ACS Energy Letters, 2021, 6 (2), 710–712.
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Advances in Storage Batteries, Layered Hybrid Perovskites and Organic Photovoltaics, and Plasma Activated Ammonia Synthesis.
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Engineering Sr-doping for enabling long-term stable FAPb1xSrxI3 quantum dots with 100% photoluminescence quantum yield.
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ACS Applied Materials and Interfaces, 2021,
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Interfacial Engineering at Quantum Dot-Sensitized TiO2 Photoelectrodes for Ultrahigh Photocurrent Generation.
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Push-pull electronic effects in surface active sites enhance electrocatalytic oxygen evolution on transition metal oxides.
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Gel–Polymer Electrolytes Based on Poly (Ionic Liquid)/Ionic Liquid Networks.
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