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 Unraveling the optical contrast in Sb2Te and AgInSbTe phase-change materials 2021 Journal of Physics Photonics article Materials Science Phase-change materials and chalcogenides Open access 15 citations An automated approach for developing neural network interatomic potentials with FLAME 2021 Computational Materials Science article Materials Science Machine Learning in Materials Science Open access 12 citations Performance of Made Simple Meta-GGA Functionals with rVV10 Nonlocal Correlation for H 2 + Cu(111), D 2 + Ag(111), H 2 + Au(111), and D 2 + Pt(111) 2021 The Journal of Physical Chemistry C article Physics and Astronomy Advanced Chemical Physics Studies Open access 23 citations P removal from Si by Si-Ca-Al alloying-leaching refining: Effect of Al and the CaAl2Si2 phase 2021 Separation and Purification Technology article Engineering Silicon and Solar Cell Technologies Open access 20 citations A simple method to calculate solution-phase free energies of charged species in computational electrocatalysis 2021 Journal of Physics Condensed Matter article Energy Electrocatalysts for Energy Conversion Open access 16 citations Eu2CuSe3 Revisited by Means of Experimental and Quantum‐Chemical Techniques 2021 European Journal of Inorganic Chemistry article Materials Science Crystal Structures and Properties 11 citations Emergence of Potential-Controlled Cu-Nanocuboids and Graphene-Covered Cu-Nanocuboids under Operando CO 2 Electroreduction 2021 Nano Letters article Energy CO2 Reduction Techniques and Catalysts Open access 93 citations Metavalent bonding induced abnormal phonon transport in diamondlike structures: Beyond conventional theory 2021 Physical review. B./Physical review. B article Materials Science Thermal properties of materials 41 citations Going beyond Pentacene: Photoemission Tomography of a Heptacene Monolayer on Ag(110) 2021 The Journal of Physical Chemistry C article Engineering Surface Chemistry and Catalysis Open access 10 citations Moireless Correlations in ABCA Graphene 2021 Hispana article Materials Science Graphene research and applications Open access 114 citations Direct and Broadband Plasmonic Charge Transfer to Enhance Water Oxidation on a Gold Electrode 2021 ACS Nano article Engineering Plasmonic and Surface Plasmon Research Open access 46 citations Moiréless correlations in ABCA graphene 2021 Proceedings of the National Academy of Sciences article Materials Science Graphene research and applications Open access 5 citations Metathesis and Redetermination of the Crystal Structure of Cadmium Carbodiimide, CdNCN 2021 Zeitschrift für anorganische und allgemeine Chemie article Chemistry Inorganic Chemistry and Materials Open access 10 citations A first-principles and machine learning combined method to investigate the interfacial friction between corrugated graphene 2021 Modelling and Simulation in Materials Science and Engineering article Materials Science Machine Learning in Materials Science 9 citations Moiré metrology of energy landscapes in van der Waals heterostructures 2021 Nature Communications article Materials Science 2D Materials and Applications Open access 97 citations Conduction Band Control of Oxyhalides with a Triple-Fluorite Layer for Visible Light Photocatalysis 2021 Journal of the American Chemical Society article Energy Advanced Photocatalysis Techniques 110 citations Moiré metrology of energy landscapes in van der Waals heterostructures 2021 RWTH Publications (RWTH Aachen) article Materials Science 2D Materials and Applications Open access 83 citations Direct MoB MBene domain formation in magnetron sputtered MoAlB thin films 2021 Nanoscale article Materials Science MXene and MAX Phase Materials Open access 63 citations Bonding diversity in rock salt-type tellurides: examining the interdependence between chemical bonding and materials properties 2021 RSC Advances article Materials Science Crystal Structures and Properties Open access 25 citations Strain-modified ionic conductivity in rare-earth substituted ceria: effects of migration direction, barriers, and defect-interactions 2021 Journal of Materials Chemistry A article Materials Science Advancements in Solid Oxide Fuel Cells 10 citations 221–240 of 295 ← Previous Page 12 / 15 Next → References 0