A quantum-chemical approach to Ni and Fe codoping in SnO2

A quantum-chemical approach to Ni and Fe codoping in SnO2

© 2016 World Scientific Publishing Company Density functional theory and generalized gradient approximation using a Hubbard-like term was employed to study tin dioxide material containing an oxygen vacancy as an intrinsic defect and being codoped simultaneously with Fe and Ni atoms. Results on atomi...

Saved in:

書目詳細資料
主要作者:	Stashans, A. (author)
格式:	article
出版:	2016
主題:	Corre
在線閱讀:	http://dspace.utpl.edu.ec/handle/123456789/18856
標簽:	添加標簽沒有標簽, 成為第一個標記此記錄!

相似書籍

Fe-doped SnO2: A Quantum-chemical Approach
由: Stashans, A.
出版: (2015)

SnO2 Physical and Chemical Properties due to the impurity doping
由: Rivera Escobar, R.
出版: (2013)

DFT study of chromium-doped SnO2 materials
由: Stashans, A.
出版: (2014)

Doping of SnO2 with H atoms: An alternative way to attain n-type conductivity
由: Stashans, A.
出版: (2016)

Ti-doped ?-Fe2O3 by quantum-chemical modeling
由: Stashans, A.
出版: (2010)

Change in the electrical conductivity of SnO2 crystal from n-type to p-type conductivity
由: Villamagua Conza, L.
出版: (2015)

Quantum-chemical study of nitrogen and magnesium co-doping in ?-Cr2O3
由: Stashans, A.
出版: (2016)

Ti-doped alpha-Fe2O3 by quantum-chemical modeling
由: Rivera Escobar, R.
出版: (2010)

A quantum-chemical study of phosphor impurity in BaTiO3 crystal
由: Stashans, A.
出版: (2007)

A quantum-chemical study of oxygen-vacancy defects in PbTiO3 crystals
由: Stashans, A.
出版: (2006)

Electronic properties of Cr-, B-doped and codoped SrTiO3
由: Stashans, A.
出版: (2017)

Electronic and Magnetic Properties of Co- and Mn-codoped ZnO by Density Functional Theory
由: Stashans, A.
出版: (2016)

Quantum chemical investigation of lanthanum doping effects in tetragonal and rhombohedral PZT materials
由: Stashans, A.
出版: (2008)

Quantum chemical study of defective chromium oxide
由: Rivera Escobar, R.
出版: (2013)

Quantum chemical study of point defects in tin dioxide
由: Rivera Escobar, R.
出版: (2014)

Quantum chemical modelling of Al-doped PZT crystals
由: Serrano, S.
出版: (2006)

A quantum mechanical study of La-doped Pb(Zr,Ti)O3
由: Stashans, A.
出版: (2007)

A quantum mechanical study of La-doped Pb(Zr,Ti)O-3
由: Stashans, A.
出版: (2006)

Propuesta y evaluación del sistema de control interno en la empresa Métodos Avanzados Industriales y Sistemas Cognos Cía. Ltda.
由: Mancheno Granja, Walter David
出版: (2015)

Physical and chemical properties of a Ga-doped ZnO crystal
由: Stashans, A.
出版: (2011)

Evaluación de control interno para la empresa Mishan Services S.A.
由: Ruiz Rubio, Edison Oswaldo
出版: (2015)

Auditoría a la gestión de Adelca Regional Cuenca
由: Cadena A., Pablo de la
出版: (2008)

Auditoría de gestión a los departamentos de compras e inventarios de la Clínica Hermano Miguel
由: Arcentales Carrión, Rodrigo Nicanor
出版: (2009)

Band gap engineering of graphene through quantum confinement and edge distortions
由: Stashans, A.
出版: (2016)

Microstructure and optical properties of ? - Fe2 O3 containing F-centres
由: Stashans, A.
出版: (2010)

Técnicas grafoplásticas como herramienta de desarrollo psicomotriz fino, en niños de 2 a 3 años del Cdi “Mi Angelito Corre” de la provincia los Rios, cantón Babahoyo, recinto la Angela.
由: Jiménez Guerra, Silvana Leonela
出版: (2019)

Electronic structure, chemical bonding, and geometry of pure and Sr-doped CaCO3
由: Stashans, A.
出版: (2007)

Tratamiento ortopédico con SN2 en paciente pediátrico con mordida abierta anterior
由: Jara Segovia, Jordick Steeven
出版: (2019)

First-principles investigation of Fe-doped MgSiO 3-ilmenite
由: Stashans, A.
出版: (2012)

Synthesis and Characterization of LaNi0.5Ti0.5O3 and La2NiTiO6 Double Perovskite Nanoparticles.
由: Córdova Calderón, José Antonio
出版: (2022)

A comparative study of structural stability, electronic, and spectroscopic properties of Carbon Quantum Dots (CQDs): a dual experimental/theoretical approach
由: Lara Vera, David Daniel
出版: (2024)

Structure, electronic properties and chemical bonding in bis(1H-imidazolium-KN3)silver(I) nitrate from periodic DFT computations
由: Stashans, A.
出版: (2017)

Aromaticity, quantum multimolecular polyhedra, and quantum QSPR fundamental equation
由: Carbo Dorca, R.
出版: (2017)

Auditoría de Gestión a la Empresa Pecalpa Cía. Ltda.
由: Cordero García, Tania Lorena
出版: (2013)

An isometric representation problem in quantum multimolecular polyhedra and similarity: (2) synisometry
由: Carbo Dorca, R.
出版: (2017)

Auditoría de gestión aplicada al departamento de cartera de la empresa Lidenar S.A.
由: Bustamante Dután, Mayra Elizabeth
出版: (2013)

Síntesis y caracterización de catalizadores bimetálicos NiK-y-Al2O3.
由: Yacchirema Silva, Carlos David
出版: (2019)

Photoinduced quantum transport
由: Alomoto Catota, Jeyson Patricio
出版: (2024)

An egg-shell bifunctional CeO2-modified NiPd/Al2O3 catalyst for petrochemical processes involving selective hydrogenation and hydroisomerization
由: Mendez, Franklin J.
出版: (2020)

Defects in TiO<inf>2</inf> crystals
由: Stashans, A.
出版: (2013)