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Journal of Physical Chemistry C, ISSN 1932-7447, 02/2013, Volume 117, Issue 5, pp. 2106 - 2112
Journal Article
The Journal of Physical Chemistry C, ISSN 1932-7447, 02/2013, Volume 117, Issue 5, pp. 2106 - 2112
The understanding of oxygen reduction reaction (ORR) activity on perovskite oxide surfaces is essential for promising future fuel cell applications. We report... 
DENSITY | SYSTEM | INSULATORS | MATERIALS SCIENCE, MULTIDISCIPLINARY | CHEMISTRY, PHYSICAL | FUEL-CELLS | NANOSCIENCE & NANOTECHNOLOGY | CATHODE MATERIALS | CATALYSTS
Journal Article
Physical Review B - Condensed Matter and Materials Physics, ISSN 1098-0121, 06/2013, Volume 87, Issue 24
We investigate the currently debated issue of the existence of the Dirac cone in silicene on an Ag(111) surface, using first-principles calculations based on... 
PHYSICS, CONDENSED MATTER | PHYSICS, APPLIED | MATERIALS SCIENCE, MULTIDISCIPLINARY
Journal Article
Physical Review B (Condensed Matter and Materials Physics), ISSN 1098-0121, 06/2015, Volume 91, Issue 24
We improvise an approach to carry out first-principles simulations of graphene-based vertical field-effect tunneling transistors that consist of a grapheneh -... 
Dielectric constant | Computer simulation | Condensed matter | Semiconductor devices | Graphene | Dielectric properties | Charge | Permittivity
Journal Article
Physical Review B (Condensed Matter and Materials Physics), ISSN 1098-0121, 07/2012, Volume 86, Issue 3
We investigate from first principles the change in transport properties of a two-dimensional azobenzene monolayer sandwiched between two Au electrodes that... 
Chemisorption | Transport properties | Electric contacts | Monolayers | Mathematical models | Conductance | Electrical junctions | Contact
Journal Article
Advanced Materials Research, ISSN 1022-6680, 06/2014, Volume 971-973, pp. 119 - 122
The transition phase and electronic properties of LiBH4 were investigated by ab initio plane-wave pseudopotential density functional theory method. According... 
Lithium borohydride | Electronic properties | Generalized gradient approximation | Phase transition
Journal Article
Advanced Materials Research, ISSN 1022-6680, 06/2014, Volume 971-973, pp. 244 - 248
ZnO hollow nanofibers were fabricated by sputtering using electrospun PVP nanofibers as templates. Scanning electron microscopy, transmission electron... 
Random lasing | ZnO hollow nanofibers | Ultraviolet emission | Photoluminescence
Journal Article
Inorganic Chemistry, ISSN 0020-1669, 09/2018, Volume 57, Issue 18, pp. 11436 - 11442
A Co-MOF, [Co (HL) ·4DMF·4H O] was simply synthesized through a one-pot solvothermal method. With the semiconductor nature, its band gap was determined to be... 
Journal Article
Nature Communications, ISSN 2041-1723, 06/2017, Volume 8, Issue 1, p. 15985
A convenient, fast and selective water analysis method is highly desirable in industrial and detection processes. Here a robust microporous Zn-MOF... 
DESIGN | HUMIDITY | FLUORESCENCE | SOLVENTS | PERFORMANCE | MULTIDISCIPLINARY SCIENCES | SENSOR | CRYSTAL | ADSORPTION | PROBE | Solvents | Water chemistry | Transformation | Films | Organic solvents | Metals | Luminescence | Photoluminescence | Blowing | Photons | Dehydration | Heat detection | Switching | Zinc | Single crystals | Emissivity | Water analysis | Zinc oxide | Ligands | Thermal imaging | Detection
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 02/2016, Volume 144, Issue 6
Journal Article
Journal of Materials Chemistry A, ISSN 2050-7488, 2018, Volume 6, Issue 24, pp. 11337 - 11345
Electron-deficient Ru/Rh half-sandwich units are optoelectronical, stereochemical, and redox and catalytically active in nature. Four different species of... 
Journal Article
Physical Review B (Condensed Matter and Materials Physics), ISSN 1098-0121, 06/2013, Volume 87, Issue 24
We investigate the currently debated issue of the existence of the Dirac cone in silicene on an Ag(111) surface, using first-principles calculations based on... 
Scanning tunneling microscopy | Silver | Band structure of solids | Condensed matter | Mathematical analysis | Density functional theory | Dispersions | Density
Journal Article
Cancer Research, ISSN 0008-5472, 07/2018, Volume 78, Issue 13 Supplement, pp. 1913 - 1913
Journal Article
PLOS ONE, ISSN 1932-6203, 01/2020, Volume 15, Issue 1, p. e0228293
Journal Article
Energy, ISSN 0360-5442, 06/2012, Volume 42, Issue 1, pp. 457 - 465
The main aim of the present study was to investigate the characteristics of products from hydrothermal treatments of cellulose in an autoclave at various... 
Solid residue | Hydrothermal | Cellulose | Bio-oil | ENERGY & FUELS | SUPERCRITICAL WATER | DECOMPOSITION | SURFACE CHARACTERIZATION | TECHNOLOGIES | THERMODYNAMICS | DIRECT LIQUEFACTION | BIOMASS | GASIFICATION | HYDROGEN-PRODUCTION | HOT-COMPRESSED WATER | Scanning electron microscopy | Residues | Hydrothermal treatment | Autoclaves | Ketones | Phenols | Aldehydes
Journal Article
Applied Physics Letters, ISSN 0003-6951, 2006, Volume 89, Issue 5
Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 05/2017, Volume 139, Issue 17, pp. 6034 - 6037
A robust Zr-MOF (LIFM-28) containing replaceable coordination sites for additional spacer installation has been employed to demonstrate a swing- or multirole... 
GAS-ADSORPTION | CHEMISTRY, MULTIDISCIPLINARY | FUNCTIONAL-GROUPS
Journal Article
Journal of Physics and Chemistry of Solids, ISSN 0022-3697, 05/2019, Volume 128, p. 343
Highlights Transition metal dichalcogenides (TMDCs), with their two-dimensional structures and sizable bandgaps, are good candidates for barrier materials in... 
Electrical conductivity | Graphene | Graphite | Dielectrics | Electric properties
Journal Article
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