September 27, 2017 article Open access Advanced capabilities for materials modelling with Q uantum ESPRESSO Journal of Physics Condensed Matter DOI: 10.1088/1361-648x/aa8f79 Full text (OA) OpenAlex Authors 0 Author list not loaded yet. Cited by 42 stored of 7,834 Search Sort Most cited Newest Oldest Patent citations Title Any typearticle review book-chapter conference-paper preprint dissertation book dataset other Any fieldAgricultural and Biological Sciences Arts and Humanities Biochemistry, Genetics and Molecular Biology Business, Management and Accounting Chemical Engineering Chemistry Computer Science Decision Sciences Dentistry Earth and Planetary Sciences Economics, Econometrics and Finance Energy Engineering Environmental Science Health Professions Immunology and Microbiology Materials Science Mathematics Medicine Neuroscience Nursing Pharmacology, Toxicology and Pharmaceutics Physics and Astronomy Psychology Social Sciences Veterinary Open access Observing the Spatial and Temporal Evolution of Exciton Wave Functions in Organic Semiconductors 2026 Physical Review X article Physics and Astronomy Laser-Matter Interactions and Applications Open access 0 citations Corresponding orbitals in periodic frozen-density embedding: The case of alkaline-earth subnitrides, Ae 2N, by the example of Ba2N 2026 The Journal of Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies 0 citations Getting the Manifold Right: The Crucial Role of Orbital Resolution in DFT+ U for Mixed d–f Electron Compounds 2026 Journal of Chemical Theory and Computation article Physics and Astronomy Advanced Chemical Physics Studies Open access 3 citations Shear-resistant topology in the quasi-one-dimensional van der Waals material Bi 4 Br 4 2025 Physical review. B./Physical review. B article Physics and Astronomy Topological Materials and Phenomena Open access 4 citations Atomate2: modular workflows for materials science 2025 Digital Discovery article Materials Science Machine Learning in Materials Science Open access 43 citations Orbital-based bonding analysis in solids 2025 Chemical Science article Physics and Astronomy Advanced Chemical Physics Studies Open access 28 citations Direct Observation of Fully Spin-Polarized Tunnel Current Between Quantum Spins Using a Single Molecule Sensor 2024 ACS Nano article Engineering Molecular Junctions and Nanostructures Open access 6 citations Magic angle of Sr 2 RuO 4 : Optimizing correlation-driven superconductivity 2024 Physical Review Research article Physics and Astronomy Physics of Superconductivity and Magnetism Open access 7 citations Atomic Insights into the Competitive Edge of Nanosheets Splitting Water 2024 Journal of the American Chemical Society article Energy Electrocatalysts for Energy Conversion Open access 17 citations Atomic insights into the competitive edge of nanosheets splitting water 2024 preprint Energy Electrocatalysts for Energy Conversion Open access 1 citations Competition between d-wave superconductivity and magnetism in uniaxially strained Sr2RuO4 2024 npj Quantum Materials article Physics and Astronomy Physics of Superconductivity and Magnetism Open access 14 citations Linking Bulk and Surface Structures in Complex Mixed Oxides 2024 ACS Catalysis article Chemical Engineering Catalysis and Oxidation Reactions Open access 7 citations Chemical Concepts in Solids 2024 other Chemistry Inorganic Chemistry and Materials Open access 1 citations Chemical bonding in phase-change chalcogenides 2024 Journal of Physics Condensed Matter article Materials Science Phase-change materials and chalcogenides Open access 27 citations Iridium Oxide Coordinatively Unsaturated Active Sites Govern the Electrocatalytic Oxidation of Water 2024 Advanced Energy Materials article Energy Electrocatalysts for Energy Conversion Open access 28 citations divERGe implements various Exact Renormalization Group examples 2024 SciPost Physics Codebases article Physics and Astronomy Physics of Superconductivity and Magnetism Open access 19 citations Tailoring chemical bonds to design unconventional glasses 2024 Proceedings of the National Academy of Sciences article Materials Science Phase-change materials and chalcogenides Open access 23 citations Delithiation-induced secondary phase formation in Li-rich cathode materials 2024 Journal of Materials Chemistry A article Engineering Advancements in Battery Materials Open access 3 citations Report on 2311.07667v1 2023 peer-review Physics and Astronomy Physics of Superconductivity and Magnetism Open access 0 citations divERGe implements various Exact Renormalization Group examples 2023 arXiv (Cornell University) preprint Physics and Astronomy Physics of Superconductivity and Magnetism Open access 0 citations 1–20 of 42 Page 1 / 3 Next → References 0