BaTiO3 perovskite for optoelectronics application: A DFT study
Authors:
- Vandana B. ParmarVPVandana B. Parmar
- Dhara RavalDRDhara Raval
- Sanjeev K. GuptaSGSanjeev K. Gupta
- P.N. GajjarPGP.N. Gajjar
- A.M. VoraAVA.M. Vora
- 20 February 2023
- journal article
- research article
- Published by Elsevier in Materials Today: Proceedings
Abstract
No abstract availableFunding Information
- University Grants Commission
- Department of Science and Technology, Ministry of Science and Technology, India
This publication has 32 references indexed in Scilit:
- On the entropy of relaxing deterministic systemsThe Journal of Chemical Physics, 2011
- Elastic, electronic and optical properties of cubic antiperovskites SbNCa3 and BiNCa3Computational Materials Science, 2009
- Ferromagneticlike Closure Domains in Ferroelectric Ultrathin Films: First-Principles SimulationsPhysical Review Letters, 2008
- Defect-Induced Photoconductivity in Layered Manganese Oxides: A Density Functional Theory StudyPhysical Review Letters, 2008
- Photophysical and Photocatalytic Properties of SrTiO3 Doped with Cr Cations on Different SitesThe Journal of Physical Chemistry B, 2006
- The SIESTA method forab initioorder-Nmaterials simulationJournal of Physics: Condensed Matter, 2002
- First-principles investigation of ferroelectricity in perovskite compoundsPhysical Review B, 1994
- Accurate and simple analytic representation of the electron-gas correlation energyPhysical Review B, 1992
- Self-interaction correction to density-functional approximations for many-electron systemsPhysical Review B, 1981
- X-ray photoelectron spectra, theoretical band structures, and densities of states for BaTiand KNbPhysical Review B, 1978