slides_chfis2016_congress.pdf (2.21 MB)
Titanium dioxide nanoparticles: the importance of shape and exposed facets in surface-molecule interactions
Version 3 2016-10-25, 00:49
Version 2 2016-10-25, 00:48
Version 1 2016-10-24, 23:14
presentation
posted on 2016-10-25, 00:49 authored by gloria tabacchigloria tabacchi, Chiara Deiana, Ettore Fois, Gianmario MartraSlides of the oral contribution presented at the XLIV National Congress of Physical Chemistry, Naples, Italy, September 20-23, 2016
This presentation was uploaded during the Open Access Week (24-30 october 2016). This year's theme was 'Open in Action':so, this a little contribution to the global initiative of sharing open data.
Note: some of the references are related to a non-openaccess paper.
However, a non-technical explanation of the research is publicly available at the following links:
https://goo.gl/4PZ7vx
https://yourmoleculardreams.wordpress.com/2016/07/25/tio2_co_bond/
Funding
FP7, SetNanoMetro project, Grant Number: 604577; Insubria University FAR2014
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- Computational chemistry
- Inorganic materials (incl. nanomaterials)
- Macromolecular materials
- Structure and dynamics of materials
- Colloid and surface chemistry
- Nanochemistry
- Supramolecular chemistry
- Physical chemistry not elsewhere classified
- Physical properties of materials
- Theoretical quantum chemistry
- Radiation and matter
- Solid state chemistry
- Analytical spectrometry
- Macromolecular and materials chemistry not elsewhere classified
- Theoretical and computational chemistry not elsewhere classified
- Theory and design of materials
- Transition metal chemistry
- Condensed matter modelling and density functional theory
- Applications in physical sciences
- Condensed matter physics not elsewhere classified
- Structural properties of condensed matter
- Surface properties of condensed matter
- Nanomaterials
- Nanofabrication, growth and self assembly
- Nanotechnology not elsewhere classified
Keywords
catalystphotocatalystnanopowderTiO2carbon monoxidedensity functional theorymodeling and simulationinfrared spectroscopyIR spectrumcharacterization techniquessurface adsorptionsurface active centerstransition metal oxidesoxide materialsoxide nanoparticlessurface activitysurface bindingbackdonationsurface sciencesurface chemistrynanotechnologysurface-molecule interactionsadsorbateOA Week 2016Computational ChemistryChemical Characterisation of MaterialsColloid and Surface ChemistryNanochemistry and Supramolecular ChemistryPhysical Chemistry not elsewhere classifiedPhysical Chemistry of MaterialsQuantum ChemistryRadiation and MatterSolid State ChemistryStructural Chemistry and SpectroscopySynthesis of MaterialsTheoretical and Computational Chemistry not elsewhere classifiedTheory and Design of MaterialsTransition Metal ChemistryCondensed Matter Modelling and Density Functional TheoryComputational PhysicsCondensed Matter Physics not elsewhere classifiedSurfaces and Structural Properties of Condensed MatterNanomaterialsNanofabrication, Growth and Self AssemblyNanotechnology not elsewhere classified
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