December 15, 1994 article Projector augmented-wave method Physical review. B, Condensed matter DOI: 10.1103/physrevb.50.17953 OpenAlex Authors 0 Author list not loaded yet. Cited by 295 stored of 93,473 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 Stacking-dependent topological magnons in bilayer CrI3 2023 Physical Review Materials article Physics and Astronomy Magnetic properties of thin films 23 citations Exploring the Interdependence between Electronically Unfavorable Situations and Pressure in a Chalcogenide Superconductor 2023 Inorganics article Physics and Astronomy Physics of Superconductivity and Magnetism Open access 2 citations The Physics of Twin Boundary Termination in Cu(In, Ga)Se2 Absorbers 2023 Solar RRL article Engineering Chalcogenide Semiconductor Thin Films Open access 4 citations On the atomistic origin of the polymorphism and the dielectric physical properties of beryllium oxide 2023 Journal of Computational Chemistry article Physics and Astronomy Advanced Chemical Physics Studies Open access 3 citations Predicting the Na + ion transport properties of NaSICON materials using density functional theory and Kinetic Monte Carlo 2023 Journal of Materials Chemistry A article Engineering Advanced Battery Materials and Technologies Open access 15 citations Modelling electro-chemically induced stresses in all-solid-state batteries: screening electrolyte and cathode materials in composite cathodes 2023 Journal of Materials Chemistry A article Engineering Advanced Battery Materials and Technologies Open access 15 citations Compositional defects in a MoAlB MAB phase thin film grown by high-power pulsed magnetron sputtering 2023 Nanoscale article Materials Science MXene and MAX Phase Materials Open access 12 citations First principles approach for promising oxide ion conducting AB Ga 3 O 7 melilite structures 2023 Physical Chemistry Chemical Physics article Materials Science Advancements in Solid Oxide Fuel Cells 2 citations Salt-flux growth of HoCuMg 4 single crystals 2023 Dalton Transactions article Physics and Astronomy Advanced Condensed Matter Physics 2 citations Exploring Solute Behavior and Texture Selection in Magnesium Alloys at the Atomistic Level 2023 SSRN Electronic Journal preprint Materials Science Magnesium Alloys: Properties and Applications Open access 0 citations Theoretical Modeling of Oxide Ion Conductivity in Doped LaSrGa3O7 Melilites 2022 The Journal of Physical Chemistry C article Materials Science Advancements in Solid Oxide Fuel Cells 0 citations Computational description of surface hydride phases on Pt(111) electrodes 2022 The Journal of Chemical Physics article Energy Electrocatalysts for Energy Conversion 18 citations Classification of properties and their relation to chemical bonding: Essential steps toward the inverse design of functional materials 2022 Science Advances article Materials Science Machine Learning in Materials Science Open access 56 citations Exploring the subtle factors that control the structural preferences in Cu7Te4 2022 Journal of Physics Condensed Matter article Materials Science Crystal Structures and Properties 10 citations Synthesis and Crystal Structure of a New Orthorhombic Polytype of Potassium Ferricyanide 2022 Zeitschrift für anorganische und allgemeine Chemie article Chemistry Crystal structures of chemical compounds 0 citations In-Gap States of HfO2 Nanoislands Driven by Crystal Nucleation: Implications for Resistive Random-Access Memory Devices 2022 ACS Applied Nano Materials article Engineering Advanced Memory and Neural Computing Open access 8 citations Chemical bonding with plane waves 2022 Elsevier eBooks book-chapter Physics and Astronomy Advanced Chemical Physics Studies 9 citations V8SiB4 — A new ternary phase in the V–Si–B system 2022 Intermetallics article Engineering Intermetallics and Advanced Alloy Properties 7 citations The Crystal Structure of Carbonic Acid 2022 Inorganics article Chemistry Crystal structures of chemical compounds Open access 13 citations Ultra-strong spin–orbit coupling and topological moiré engineering in twisted ZrS2 bilayers 2022 Nature Communications article Physics and Astronomy Topological Materials and Phenomena Open access 39 citations 141–160 of 295 ← Previous Page 8 / 15 Next → References 0