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Materials Data on ZnNiP2O7 (SG:2) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

X-ray Diffraction in CrystallographyMicrowave Dielectric Ceramics SynthesisAdvanced ceramic materials synthesis

Materials Data on Zn3Si3(NiO6)2 (SG:230) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Microwave Dielectric Ceramics SynthesisPigment Synthesis and PropertiesX-ray Diffraction in Crystallography

Materials Data on BiSbO5 (SG:61) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Advancements in Solid Oxide Fuel CellsMachine Learning in Materials ScienceX-ray Diffraction in Crystallography

Materials Data on Li4Ti3Co2Sn3O16 (SG:8) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Advancements in Battery MaterialsX-ray Diffraction in CrystallographyExtraction and Separation Processes

Materials Data on Mg2Ta2VO8 (SG:15) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Microwave Dielectric Ceramics SynthesisPigment Synthesis and PropertiesLuminescence Properties of Advanced Materials

Materials Data on BaV8O21 (SG:2) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Crystal Structures and PropertiesCatalysis and Oxidation ReactionsPolyoxometalates: Synthesis and Applications

Materials Data on Fe3Co(PO4)4 (SG:6) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Chemical Synthesis and CharacterizationNuclear materials and radiation effectsX-ray Diffraction in Crystallography

Materials Data on Li5Cr2Fe3(PO4)6 (SG:1) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Advancements in Battery MaterialsX-ray Diffraction in Crystallography

Materials Data on Ho14(PbS8)3 by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Ho14(PbS8)3 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are fourteen inequivalent Ho3+ sites. In the first Ho3+ site, Ho3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Ho–S bond distances ranging from 2.73–3.13 Å. In the second Ho3+ site, Ho…

Solid-state spectroscopy and crystallographyX-ray Diffraction in CrystallographyCrystal Structures and Properties

Materials Data on Na3Li5Mn5O9 (SG:1) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Ferroelectric and Piezoelectric MaterialsX-ray Diffraction in CrystallographyNuclear materials and radiation effects

Materials Data on Fe3(OF2)2 (SG:5) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

X-ray Diffraction in CrystallographyInorganic Chemistry and MaterialsInorganic Fluorides and Related Compounds

Materials Data on Ti3AlO6 by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

MXene and MAX Phase MaterialsIntermetallics and Advanced Alloy Properties

Materials Data on LiNiPO4 (SG:2) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

X-ray Diffraction in CrystallographyAdvancements in Battery MaterialsAdvanced ceramic materials synthesis

InxGa1-xN/GaN MQWs heterostructures for solar cells applications

Ezgi Dogmus、Ludovic Largeau、Nathalie Rolland 等 4 位作者2014-01-01HAL (Le Centre pour la Communication Scientifique Directe)

The high quality and high indium content InxGa1-xN/GaN (x~ 0.10 and x~0.30) multiple quantum wells (MQWs) grown on sapphire (0001) by metal-organic chemical vapor deposition (MOCVD) were investigated by High Angle Annular Dark Field Scanning Transmission Electron Microscopy (HAADF-STEM), Energy dispersive X-ray spectr…

Nanowire Synthesis and ApplicationsZnO doping and propertiesGaN-based semiconductor devices and materials

Materials Data on LiVCr(P2O7)2 (SG:1) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Molten salt chemistry and electrochemical processesPigment Synthesis and PropertiesAdvanced ceramic materials synthesis

Materials Data on Mg(WO2)2 (SG:59) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Inorganic Fluorides and Related CompoundsSolid-state spectroscopy and crystallographyX-ray Diffraction in Crystallography

Materials Data on Rb16Yb3Ti13(PO4)24 by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Rb16Yb3Ti13(PO4)24 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are sixteen inequivalent Rb sites. In the first Rb site, Rb is bonded in a 12-coordinate geometry to twelve O atoms. There are a spread of Rb–O bond distances ranging from 2.84–3.37 Å. In the second Rb site, Rb i…

Ferroelectric and Piezoelectric MaterialsMicrowave Dielectric Ceramics SynthesisSolid-state spectroscopy and crystallography

Mécanisme de transport dans des jauges de contraintes à nanoparticules colloïdales

Moussa Biaye、H. Diesinger、Nicolas Decorde 等 7 位作者2014-01-01HAL (Le Centre pour la Communication Scientifique Directe)

Les écrans tactiles envahissent notre quotidien (smartphones, tablettes ...). Dans ce travail, l'objectif est de caractériser des surfaces tactiles résistives basées sur le transport à travers des couches autoassemblées de nanoparticules (NPs) métalliques. Il s'agit d'utiliser la microscopie à force atomique pour adre…

Pickering emulsions and particle stabilization

Materials Data on Rb2LiV(PO4)2 (SG:19) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Microwave Dielectric Ceramics SynthesisSolid-state spectroscopy and crystallography

Materials Data on MgTi2O4 (SG:63) by Materials Project

None Available2014-01-01OSTI OAI (U.S. Department of Energy Office of Scientific and Technical Information)

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Advanced ceramic materials synthesis