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RESEARCH PAPER · Physical Chemistry Chemical Physics · 2020

Interfacial electronic features in methyl-ammonium lead iodide and p-type oxide heterostructures: new insights for inverted perovskite solar cells

Adriana Pecoraro, Antonella De Maria, Paola Delli Veneri, Michele Pavone, Ana Belen Muñoz-García

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Interfacial electronic features in methyl-ammonium lead iodide and p-type oxide heterostructures: new insights for inverted perovskite solar cellsOriginalWhat defines biomimetic and bioinspired science and engineering?8Interfaces and Interfacial Carrier Dynamics in Perovskites17Rational Design of Semiconductor Heterojunctions for Photocatalysis101Band offset in semiconductor heterojunctions44Development of SnO2 Composites as Electron Transport Layer in Unencapsulated CH3NH3PbI3 Solar Cells9Electronic structure and interfacial features of triphenylamine- and phenothiazine-based hole transport materials for methylammonium lead iodide perovskite solar cells13Quantum confinement in chalcogenides 2D nanostructures from first principles11First-Principles Study of Cu-Based Inorganic Hole Transport Materials for Solar Cell Applications11Impact of dynamic co-evaporation schemes on the growth of methylammonium lead iodide absorbers for inverted solar cells7First-principles study of interfacial features and charge dynamics between spiro-MeOTAD and photoactive lead halide perovskites14The role of Mg dopant concentration in tuning the performance of the SnO 2 electron transport layer in perovskite solar cells21Exotic hexagonal NaCl atom-thin layer on methylammonium lead iodide perovskite: new hints for perovskite solar cells from first-principles calculations3Adhesion, stability, structural and electronic properties of perovskite/BaWO 4 heterostructures: first-principles and experimental characterizations7Factors influencing charge transport at perovskite–charge transport layer interfaces: current strategies, challenges, and perspectives based on first-principles studies7Elucidating Structural and Electronic Features of PEO/(101)-TiO2 Anatase Interfaces through First-Principles Metadynamics Simulations2Optical and charge transport properties of methylammonium versus triple-cation lead halide perovskites: a combined theoretical and experimental study1Unveiling enhanced hole transfer mechanism in perovskite solar cells with a self-assembled monolayer and [1]benzothieno[3,2-b][1]benzothiophene interlayer3Electronic Structure and Interfacial Hole Transfer in a Di-Rhodium Photocatalyst on a p-Type NiO Electrode0

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18 direct citing papers saved.

  1. What defines biomimetic and bioinspired science and engineering?

    Pure and Applied Chemistry · 2021-06-23

    Katarzyna Rybicka‐Jasińska, James B. Derr, Valentine Ivanov Vullev

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  2. Interfaces and Interfacial Carrier Dynamics in Perovskites

    The Journal of Physical Chemistry C · 2021-07-08

    Ibrahim Alfurayj, Zhongguo Li, Clemens Burda

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  3. Rational Design of Semiconductor Heterojunctions for Photocatalysis

    Chemistry - A European Journal · 2021-07-15

    Giovanni Di Liberto, Luis A. Cipriano, Sergio Tosoni, Gianfranco Pacchioni

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  4. Band offset in semiconductor heterojunctions

    Journal of Physics Condensed Matter · 2021-07-20

    Giovanni Di Liberto, Gianfranco Pacchioni

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  5. Development of SnO2 Composites as Electron Transport Layer in Unencapsulated CH3NH3PbI3 Solar Cells

    Solids · 2021-12-15

    Gennaro Vincenzo Sannino, Antonella De Maria, VERA LA FERRARA, Gabriella Rametta, Lucia Vittoria Mercaldo, Maria Luisa Addonizio, L. Lancellotti, Adriana Pecoraro, Ana Belen Muñoz-García, Michele Pavone, Paola Delli Veneri

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  6. Electronic structure and interfacial features of triphenylamine- and phenothiazine-based hole transport materials for methylammonium lead iodide perovskite solar cells

    Physical Chemistry Chemical Physics · 2022-01-01

    Carmen Coppola, Adriana Pecoraro, Ana Belen Muñoz-García, Rossella Infantino, Alessio Dessì, Gianna Reginato, Riccardo Basosi, Adalgisa Sinicropi, Michele Pavone

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  7. Quantum confinement in chalcogenides 2D nanostructures from first principles

    Journal of Physics Condensed Matter · 2022-07-22

    Tilak Das, Giovanni Di Liberto, Gianfranco Pacchioni

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  8. First-Principles Study of Cu-Based Inorganic Hole Transport Materials for Solar Cell Applications

    Materials · 2022-08-18

    Adriana Pecoraro, Pasqualino Maddalena, Michele Pavone, Ana Belen Muñoz-García

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  9. Impact of dynamic co-evaporation schemes on the growth of methylammonium lead iodide absorbers for inverted solar cells

    Scientific Reports · 2022-11-10

    Robert Heidrich, Karl L. Heinze, Sebastian Berwig, Jie Ge, Roland Scheer, Paul Pistor

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  10. First-principles study of interfacial features and charge dynamics between spiro-MeOTAD and photoactive lead halide perovskites

    Chemical Communications · 2023-01-01

    Adriana Pecoraro, Francesca Fasulo, Michele Pavone, Ana Belen Muñoz-García

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  11. The role of Mg dopant concentration in tuning the performance of the SnO 2 electron transport layer in perovskite solar cells

    Sustainable Energy & Fuels · 2023-01-01

    Gennaro Vincenzo Sannino, Adriana Pecoraro, Pasqualino Maddalena, Annalisa Bruno, Paola Delli Veneri, Michele Pavone, Ana Belen Muñoz-García

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  12. Exotic hexagonal NaCl atom-thin layer on methylammonium lead iodide perovskite: new hints for perovskite solar cells from first-principles calculations

    Physical Chemistry Chemical Physics · 2023-12-14

    Adriana Pecoraro, Ana Belen Muñoz-García, Gennaro Vincenzo Sannino, Paola Delli Veneri, Michele Pavone

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  13. Adhesion, stability, structural and electronic properties of perovskite/BaWO 4 heterostructures: first-principles and experimental characterizations

    Inorganic Chemistry Frontiers · 2024-01-01

    Yao Guo, Shiding Zhang, Zhaoyu Zhang, Yuanbin Xue, Jianxin Li, Haixiang Song, Yuhua Wang, Qing Shen

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  14. Factors influencing charge transport at perovskite–charge transport layer interfaces: current strategies, challenges, and perspectives based on first-principles studies

    Journal of Physics D Applied Physics · 2024-05-20

    Labanya Bhattacharya, Maytal Caspary Toroker

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  15. Elucidating Structural and Electronic Features of PEO/(101)-TiO2 Anatase Interfaces through First-Principles Metadynamics Simulations

    The Journal of Physical Chemistry C · 2024-11-18

    Arianna Massaro, Francesca Fasulo, Ana Belen Muñoz-García, Michele Pavone

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  16. Optical and charge transport properties of methylammonium versus triple-cation lead halide perovskites: a combined theoretical and experimental study

    Journal of Physics Energy · 2025-04-02

    Adriana Pecoraro, Francesca Fasulo, Carmen Serpico, Gennaro Vincenzo Sannino, Lucia Vittoria Mercaldo, Paola Delli Veneri, Michele Pavone, Ana Belen Muñoz-García

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  17. Unveiling enhanced hole transfer mechanism in perovskite solar cells with a self-assembled monolayer and [1]benzothieno[3,2-b][1]benzothiophene interlayer

    Journal of Materials Chemistry A · 2025-07-22

    Adriana Pecoraro, Francesca Fasulo, Michele Pavone, Aldo Di Carlo, Ana Belen Muñoz-García

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  18. Electronic Structure and Interfacial Hole Transfer in a Di-Rhodium Photocatalyst on a p-Type NiO Electrode

    The Journal of Physical Chemistry C · 2025-10-28

    Francesca Fasulo, Adriana Pecoraro, Ana Belen Muñoz-García, Michele Pavone

    Read original paper ↗ ·
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