Publications by authors named "Julia Wiktor"

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Revealing the Low-Temperature Phase of FAPbI Using a Machine-Learned Potential.
Sangita Dutta, Erik Fransson, Tobias Hainer, Benjamin M Gallant, Dominik J Kubicki, Julia Wiktor

J Am Chem Soc· October 2025

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A morphotropic phase boundary in MAFAPbI: linking structure, dynamics, and electronic properties.
Tobias Hainer, Erik Fransson, Sangita Dutta, Julia Wiktor, Paul Erhart

Nat Commun· October 2025

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Competing Self-Trapped Exciton States and Multiple Emission Pathways in BiVO.
Tobias Möslinger, Nicklas Österbacka, Julia Wiktor

J Phys Chem Lett· July 2025

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Computational Assessment of - Curves and Tunability of 2D Semiconductor van der Waals Heterostructures.
Qiuhua Liang, Samuel Lara-Avila, Sergey Kubatkin, Md Anamul Hoque, Saroj Prasad Dash, Julia Wiktor

Nano Lett· February 2025

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Ultranarrow Semiconductor WS Nanoribbon Field-Effect Transistors.
Md Anamul Hoque, Alexander Yu Polyakov, Battulga Munkhbat, Konstantina Iordanidou, Abhay V Agrawal, Julia Wiktor

Nano Lett· February 2025

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Identification and Suppression of Point Defects in Bromide Perovskite Single Crystals Enabling Gamma-Ray Spectroscopy.
Zhenyi Ni, Liang Zhao, Zhifang Shi, Aryaveer Singh, Julia Wiktor

Adv Mater· August 2024

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Direct, Indirect, and Self-Trapped Excitons in CsAgBiBr.
Mehmet Baskurt, Paul Erhart, Julia Wiktor

J Phys Chem Lett· August 2024

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Electron Localization and Mobility in Monolayer Fullerene Networks.
Amedeo Capobianco, Julia Wiktor, Alessandro Landi, Francesco Ambrosio, Andrea Peluso

Nano Lett· July 2024

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Charge Localization in Acene Crystals from Electronic Structure.
Francesco Ambrosio, Julia Wiktor, Alessandro Landi, Andrea Peluso

J Phys Chem Lett· April 2023

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Cubic or Not Cubic? Combined Experimental and Computational Investigation of the Short-Range Order of Tin Halide Perovskites.
Marta Morana, Julia Wiktor, Mauro Coduri, Rossella Chiara, Carlotta Giacobbe

J Phys Chem Lett· March 2023

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Electric Field and Strain Tuning of 2D Semiconductor van der Waals Heterostructures for Tunnel Field-Effect Transistors.
Konstantina Iordanidou, Richa Mitra, Naveen Shetty, Samuel Lara-Avila, Saroj Dash, Julia Wiktor

ACS Appl Mater Interfaces· January 2023

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Atomic-Level Description of Thermal Fluctuations in Inorganic Lead Halide Perovskites.
Oliviero Cannelli, Julia Wiktor, Nicola Colonna, Ludmila Leroy, Michele Puppin

J Phys Chem Lett· April 2022

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Identification of lead vacancy defects in lead halide perovskites.
David J Keeble, Julia Wiktor, Sandeep K Pathak, Laurie J Phillips, Marcel Dickmann

Nat Commun· September 2021

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Strong Electron Localization in Tin Halide Perovskites.
Hassan Ouhbi, Francesco Ambrosio, Filippo De Angelis, Julia Wiktor

J Phys Chem Lett· June 2021

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Low-Frequency Dielectric Response of Tetragonal Perovskite CHNHPbI.
Ethan Berger, Julia Wiktor, Alfredo Pasquarello

J Phys Chem Lett· August 2020

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ABINIT: Overview and focus on selected capabilities.
Aldo H Romero, Douglas C Allan, Bernard Amadon, Gabriel Antonius, Thomas Applencourt, Julia Wiktor

J Chem Phys· March 2020

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Strong Hole Trapping Due to Oxygen Dimers in BiVO: Effect on the Water Oxidation Reaction.
Francesco Ambrosio, Julia Wiktor

J Phys Chem Lett· November 2019

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Electron and Hole Polarons at the BiVO-Water Interface.
Julia Wiktor, Alfredo Pasquarello

ACS Appl Mater Interfaces· May 2019

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Sizable Excitonic Effects Undermining the Photocatalytic Efficiency of β-CuVO.
Julia Wiktor, Igor Reshetnyak, Michal Strach, Mariateresa Scarongella, Raffaella Buonsanti

J Phys Chem Lett· October 2018

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pH-Dependent Surface Chemistry from First Principles: Application to the BiVO(010)-Water Interface.
Francesco Ambrosio, Julia Wiktor, Alfredo Pasquarello

ACS Appl Mater Interfaces· March 2018

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Note: Assessment of the SCAN+rVV10 functional for the structure of liquid water.
Julia Wiktor, Francesco Ambrosio, Alfredo Pasquarello

J Chem Phys· December 2017

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Predictive Determination of Band Gaps of Inorganic Halide Perovskites.
Julia Wiktor, Ursula Rothlisberger, Alfredo Pasquarello

J Phys Chem Lett· November 2017

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Partial Molar Volumes of Aqua Ions from First Principles.
Julia Wiktor, Fabien Bruneval, Alfredo Pasquarello

J Chem Theory Comput· August 2017

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First-principles calculations of momentum distributions of annihilating electron-positron pairs in defects in UO.
Julia Wiktor, Gérald Jomard, Marc Torrent, Marjorie Bertolus

J Phys Condens Matter· January 2017

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DFT + U investigation of charged point defects and clusters in UO2.
Emerson Vathonne, Julia Wiktor, Michel Freyss, Gérald Jomard, Marjorie Bertolus

J Phys Condens Matter· August 2014

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