Modeling of the interactions between defect vanadium dioxide surface and water and/or ethanol molecules
The temperature of phase transition (TPT) has been shown in experimental way to decrease or increase due to adsorption of water or ethanol respectively on VO2 surface. An excess of water vapor results in semiconductor degradation into insulator. Quantum chemical analysis of changes in the electron s...
Saved in:
| Date: | 2008 |
|---|---|
| Main Authors: | Kaurkovskaya, V. N., Grebenyuk, A. G., Lobanov, V. V. |
| Format: | Article |
| Language: | Russian |
| Published: |
Chuiko Institute of Surface Chemistry National Academy of Sciences of Ukraine
2008
|
| Online Access: | https://surfacezbir.com.ua/index.php/surface/article/view/252 |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
| Journal Title: | Surface |
| Download file: | |
Institution
SurfaceSimilar Items
Theoretical study on the pressure-induced phase transition in vanadium dioxide
by: A.G. Grebenyuk, et al.
Published: (2015)
by: A.G. Grebenyuk, et al.
Published: (2015)
Quantum chemical simulation of the effect of adsorption of water and methanol molecules on the parameters of phase transition in vanadium dioxide
by: V. M. Kaurkovska, et al.
Published: (2015)
by: V. M. Kaurkovska, et al.
Published: (2015)
Simulation of the interaction potential between water molecules
by: M. V. Tymofieiev
Published: (2016)
by: M. V. Tymofieiev
Published: (2016)
Simulation of the interaction potential between water molecules
by: M. V. Timofeev
Published: (2016)
by: M. V. Timofeev
Published: (2016)
Spectroscopy of fullerene-like molecules of silicon dioxide
by: O. V. Filonenko, et al.
Published: (2013)
by: O. V. Filonenko, et al.
Published: (2013)
Chemical environment of water molecules adsorbed on the anatase surface: quantum chemical study
by: O. V. Smirnova, et al.
Published: (2019)
by: O. V. Smirnova, et al.
Published: (2019)
Role of Ionized States of Water Molecules in the Reaction of Hydrolysis of Saccharose on Silica Surfaces
by: Tsendra, O.M., et al.
Published: (2010)
by: Tsendra, O.M., et al.
Published: (2010)
Interaction of water molecules with hydrophilic and hydrophobic surfaces of colloid particle
by: Ju. I. Tarasevich, et al.
Published: (2015)
by: Ju. I. Tarasevich, et al.
Published: (2015)
Modelling of potentials for interparticle interactions between methanol molecules
by: Malomuzh, N.P., et al.
Published: (2017)
by: Malomuzh, N.P., et al.
Published: (2017)
Titanium dioxide defect structures as catalytic sites
by: O. V. Smirnova, et al.
Published: (2017)
by: O. V. Smirnova, et al.
Published: (2017)
Quantum chemical simulation of the interaction between silica surface and sulfuric acid
by: Kravchenko, A. A., et al.
Published: (2007)
by: Kravchenko, A. A., et al.
Published: (2007)
Computer simulation of vanadium dioxide semiconductor phase formation in supersaturated solutions
by: I. M. Chernenko, et al.
Published: (2011)
by: I. M. Chernenko, et al.
Published: (2011)
Computer simulation of vanadium dioxide semiconductor phase formation in supersaturated solutions
by: Chernenko, I.M., et al.
Published: (2011)
by: Chernenko, I.M., et al.
Published: (2011)
Electrical conductivity of the "polyethylene — vanadium dioxide" composite
by: E. V. Antonova, et al.
Published: (2013)
by: E. V. Antonova, et al.
Published: (2013)
Nitrogen dioxide and ammonia gas molecules interaction studies on phosphorene nanosheet — a DFT investigation
by: Nagarajan, V., et al.
Published: (2019)
by: Nagarajan, V., et al.
Published: (2019)
Structure and dielectric properties in the radio frequency range of polymer composites based on vanadium dioxide
by: V. R. Kolbunov, et al.
Published: (2015)
by: V. R. Kolbunov, et al.
Published: (2015)
Quantumchemical calculation of 29Si NMR spectrum of silicon dioxide fullerene-like molecules
by: O. V. Filonenko, et al.
Published: (2015)
by: O. V. Filonenko, et al.
Published: (2015)
Interaction of valine with water molecules: Raman and DFT study
by: A. Zhumabaiev, et al.
Published: (2022)
by: A. Zhumabaiev, et al.
Published: (2022)
Interaction of valine with water molecules: Raman and DFT study
by: A. Jumabaev, et al.
Published: (2022)
by: A. Jumabaev, et al.
Published: (2022)
Sorption of natural flavonoids on the surface of pyrogenic aluminum oxide from water-ethanol solutions
by: V. M. Barvinchenko, et al.
Published: (2020)
by: V. M. Barvinchenko, et al.
Published: (2020)
The interaction of tantal and vanadium with high content of phosphorus
by: Ya. Lomnytska, et al.
Published: (2019)
by: Ya. Lomnytska, et al.
Published: (2019)
Simulation of the interaction between silica surface and acid or alkaline aqueous media
by: A. A. Kravchenko, et al.
Published: (2015)
by: A. A. Kravchenko, et al.
Published: (2015)
Simulation of the interaction between silica surface and acid or alkaline aqueous media
by: Kravchenko, A.A., et al.
Published: (2015)
by: Kravchenko, A.A., et al.
Published: (2015)
Effect of zirconium doping on the properties of defect titanium dioxide films: quantum chemical calculations
by: O. V. Smirnova, et al.
Published: (2019)
by: O. V. Smirnova, et al.
Published: (2019)
Refractometry of water–ethanol solutions near their contraction point
by: L. A. Bulavin, et al.
Published: (2015)
by: L. A. Bulavin, et al.
Published: (2015)
Refractometry of water–ethanol solutions near their contraction point
by: L. A. Bulavin, et al.
Published: (2015)
by: L. A. Bulavin, et al.
Published: (2015)
Quantum chemical modeling of intermolecular interactionsof fullerene-like silicon dioxide molecules (SiO2)n(H2O)n/2
by: O. V. Filonenko, et al.
Published: (2014)
by: O. V. Filonenko, et al.
Published: (2014)
Kinematic shear Vvscosity of water, aqueous solutions of electrolytes, and ethanol
by: V. M. Makhlaichuk
Published: (2015)
by: V. M. Makhlaichuk
Published: (2015)
Kinematic shear Vvscosity of water, aqueous solutions of electrolytes, and ethanol
by: V. M. Makhlaichuk
Published: (2015)
by: V. M. Makhlaichuk
Published: (2015)
Recharging processes of point defects in zirconium dioxide nanoscale particles
by: V. V. Bevz
Published: (2009)
by: V. V. Bevz
Published: (2009)
Physical properties comparison between hafnium and vanadium carbonitride coatings
by: J. C. Caicedo, et al.
Published: (2020)
by: J. C. Caicedo, et al.
Published: (2020)
EA density functional study of the adsorption of carbon dioxide molecule on graphene
by: D. P. Thakur, et al.
Published: (2013)
by: D. P. Thakur, et al.
Published: (2013)
EA density functional study of the adsorption of carbon dioxide molecule on graphene
by: D. P. Thakur, et al.
Published: (2013)
by: D. P. Thakur, et al.
Published: (2013)
Stabilizing small particles of lithium hydroxide with adsorbed water molecules: a quantum chemical study
by: Grebenyuk, A.G.
Published: (2002)
by: Grebenyuk, A.G.
Published: (2002)
Stabilizing small particles of lithium hydroxide with adsorbed water molecules: a quantum chemical study
by: Grebenyuk, A. G.
Published: (2002)
by: Grebenyuk, A. G.
Published: (2002)
Analysis of the interaction between N-acetylneuraminic acid and disaccharides on silica surface
by: L. M. Ushakova, et al.
Published: (2020)
by: L. M. Ushakova, et al.
Published: (2020)
Calculation of adsorption and interaction mechanisms of O₂ and CO₂ molecules on BaTiO₃ surface
by: Sejkovskij, I.D., et al.
Published: (2003)
by: Sejkovskij, I.D., et al.
Published: (2003)
Ethanol-water acetic acid Synthesis over copper-oxide catalysts
by: M. E. Sharanda
Published: (2013)
by: M. E. Sharanda
Published: (2013)
Stereochemical aspects of the reactivity of sorbed molecules and functional groups of silica surface
by: Chuiko, A. A., et al.
Published: (2006)
by: Chuiko, A. A., et al.
Published: (2006)
Plasma’s kinetics in discharge in mixture of air, water and ethanol steams and the questions of alternative fuel
by: Shchedrin, A.I., et al.
Published: (2008)
by: Shchedrin, A.I., et al.
Published: (2008)
Similar Items
-
Theoretical study on the pressure-induced phase transition in vanadium dioxide
by: A.G. Grebenyuk, et al.
Published: (2015) -
Quantum chemical simulation of the effect of adsorption of water and methanol molecules on the parameters of phase transition in vanadium dioxide
by: V. M. Kaurkovska, et al.
Published: (2015) -
Simulation of the interaction potential between water molecules
by: M. V. Tymofieiev
Published: (2016) -
Simulation of the interaction potential between water molecules
by: M. V. Timofeev
Published: (2016) -
Spectroscopy of fullerene-like molecules of silicon dioxide
by: O. V. Filonenko, et al.
Published: (2013)