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Neues Jahrbuch für Mineralogie - Abhandlungen, ISSN 0077-7757, 8/2018, Volume 195, Issue 2, pp. 89 - 100
Determination of the crystal structure of a new calcium alumoferrite has proved it to be a monoclinic variant of the previously determined SFCA-type, triclinic... 
crystal structure | silico-ferrites of calcium and aluminium | polysomatism | monoclinic variants of sfca-types
Journal Article
physica status solidi (b), ISSN 0370-1972, 04/2015, Volume 252, Issue 4, pp. 828 - 832
Gallium oxide is increasingly used in a variety of applications, but confusion reigns over the Brillouin zone and the band structure of monoclinic β‐Ga2O3. We... 
first‐principles calculations | gallium oxide | monoclinic structures | band gap | Brillouin zone | First-principles calculations | Band gap | Monoclinic structures | Gallium oxide | THIN-FILMS | PHYSICS, CONDENSED MATTER | first-principles calculations | WANNIER FUNCTIONS | SINGLE-CRYSTALS | BILBAO CRYSTALLOGRAPHIC SERVER | GROWTH | ABSORPTION | EDGE
Journal Article
Journal of Catalysis, ISSN 0021-9517, 10/2012, Volume 294, pp. 119 - 127
Oxidized/partially reduced hexagonal (h-) and monoclinic (m-) WO3 nanoparticles were tested as photocatalysts both in the aqueous and in the gaseous phase.... 
Monoclinic | WO3 | Hexagonal | Photocatalysis | HEXAGONAL WO3 | TUNGSTEN TRIOXIDE | PHOTOACTIVITY | STABILITY | CHEMISTRY, PHYSICAL | ENGINEERING, CHEMICAL | REMOVAL | METHYL-ORANGE | DOPED TITANIA | DEGRADATION | NANOTUBES | TIO2
Journal Article
Journal of Catalysis, ISSN 0021-9517, 10/2012, Volume 294, pp. 119 - 127
Hexagonal (h-) and monoclinic (m-) WO nanoparticles with controlled composition (oxidized/yellow color or partially reduced/blue color) were prepared through... 
Monoclinic | Hexagonal | Photocatalysis
Journal Article
physica status solidi (b), ISSN 0370-1972, 08/2019, Volume 256, Issue 8, p. n/a
Li2(NbxMn1–x)O3 is one of the Li‐rich, Mn‐based cathode materials represented by the structural prototype Li2MnO3. Many of these cathode materials crystallize... 
cathode materials | NaCl‐type structure | powder structure analysis | density functional theory | Li2NbO3–Li2MnO3 pseudo‐binary compound | SYSTEM | PHYSICS, CONDENSED MATTER | NaCl-type structure | LI2MNO3 | GE2SB2TE5 | Li2NbO3-Li2MnO3 pseudo-binary compound | Density functionals | Specific gravity | Analysis
Journal Article
Journal of Physics D: Applied Physics, ISSN 0022-3727, 2015, Volume 48, Issue 19, pp. 195302 - 20
Hydroxyapatite (HAp) was studied from a first principle approach using the local density approximation (LDA) method in AIMPRO code, in combination with various... 
Hydroxyapatite | Defects: vacancy | Modeling | Structures and properties | Interstitials | Substitutions | REFINEMENT | hydroxyapatite | PHYSICS, APPLIED | modeling | substitutions | interstitials | SILICON | structures and properties | defects: vacancy | COMPUTER-SIMULATION | MONOCLINIC HYDROXYAPATITE | BONE | Energy gap | Molecular structure | Computation | Mathematical analysis | Electronics | Density | Defects
Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 03/2018, Volume 140, Issue 10, pp. 3751 - 3759
Some metal–organic frameworks (MOFs) incorporate nodes that are metal oxide clusters such as Zr6O8. Vacancies on the node surfaces, accidental or by design,... 
DIETHYL-ETHER | ENERGY | CLUSTERS | MONOCLINIC ZIRCONIA | UIO-66 | SITES | CONSEQUENCES | BASIS-SETS | CHEMISTRY, MULTIDISCIPLINARY | PROTON TOPOLOGY | WATER | Alcohol, Denatured | Analysis | Oxides | Alcohol | Structure | Chemical synthesis | Magnetic properties
Journal Article
Surface Science, ISSN 0039-6028, 01/2019, Volume 679, pp. 180 - 187
We have studied zirconia films on a Rh(111) substrate with thicknesses in the range of 2–10 monolayers (ML) using scanning tunneling microscopy (STM) and... 
Low-energy electron diffraction | Phase transformation | Scanning tunneling microscopy | Monoclinic and tetragonal zirconia | Zirconium oxide | Thin film growth | Physics - Materials Science
Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 12/2018, Volume 149, Issue 22, p. 224506
Ambient temperature static high pressure compression of liquid nitroethane has been performed using the diamond anvil technique. The first transition to a... 
CHEMISTRY, PHYSICAL | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | Monoclinic lattice | Computer simulation | Enthalpy | Diamonds | Liquid-solid transition | Preferred orientation | Hydrogen bonding | Unit cell | Ambient temperature | Predictions | Density functional theory | Residual stress | Crystal structure | Indexing
Journal Article
Journal Article
Crystallography Reports, ISSN 1063-7745, 12/2017, Volume 62, Issue 7, pp. 1060 - 1062
Journal Article
Zeitschrift für anorganische und allgemeine Chemie, ISSN 0044-2313, 12/2018, Volume 644, Issue 24, pp. 1754 - 1759
Complexes of C11H10N2Cu2Br3 (1) and C22H20N4Cu8I10 (2) [C22H20N4 = 1,1"‐(1,2‐ethanediyl)‐bis‐4,4′‐bipyridinium] were synthesized via the microwave‐assisted... 
Microwave‐assisted synthesis | Copper | Halides | Crystal structure | COPPER(I) BROMIDE | ALKYLATION | Microwave-assisted synthesis | NETWORKS | ORGANIC FRAMEWORK | LIGAND | COORDINATION POLYMERS | ARCHITECTURES | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article