First-principles study of SnO under high pressure
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journal
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December 2016 |
Generalized Gradient Approximation Made Simple
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journal
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October 1996 |
Projector augmented-wave method
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journal
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December 1994 |
Electronic structural, optical and phonon lattice dynamical properties of pure- and La-doped SrTiO 3 : An ab initio thermodynamics study
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journal
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December 2017 |
First-principles calculations of structural, electronic and optical properties of tetragonal SnO2 and SnO
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journal
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February 2010 |
Unveiling origin of additional capacity of SnO2 anode in lithium-ion batteries by realistic ex situ TEM analysis
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journal
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January 2016 |
Roadmap on optical sensors
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journal
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July 2017 |
Recent developments in the ABINIT software package
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journal
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August 2016 |
High response ethanol gas sensor based on orthorhombic and tetragonal SnO2
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journal
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July 2020 |
Temperature Dependence of the Energy Levels of Methylammonium Lead Iodide Perovskite from First-Principles
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journal
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November 2016 |
In-situ and ex-situ characterization of TiO 2 and Au nanoparticle incorporated TiO 2 thin films for optical gas sensing at extreme temperatures
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journal
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March 2012 |
Optimized norm-conserving Vanderbilt pseudopotentials
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journal
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August 2013 |
First-principles calculations of the electronic structure and spectra of strongly correlated systems: the LDA + U method
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journal
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January 1997 |
Metal oxides for solid-state gas sensors: What determines our choice?
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journal
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April 2007 |
Electronic properties and stabilities of bulk and low-index surfaces of SnO in comparison with : A first-principles density functional approach with an empirical correction of van der Waals interactions
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journal
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January 2008 |
Plasmonic Conducting Metal Oxide-Based Optical Fiber Sensors for Chemical and Intermediate Temperature-Sensing Applications
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journal
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November 2018 |
Ab initiomolecular dynamics for liquid metals
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journal
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January 1993 |
First-principles calculations reveal controlling principles for carrier mobilities in semiconductors
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journal
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October 2016 |
High temperature optical sensing of gas and temperature using Au-nanoparticle incorporated oxides
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journal
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October 2014 |
Effects of Electron–Phonon Coupling on Electronic Properties of Methylammonium Lead Iodide Perovskites
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journal
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December 2018 |
Temperature Dependence of the Energy Gap in Monatomic Semiconductors
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journal
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June 1950 |
Lattice dynamics and electron-phonon coupling calculations using nondiagonal supercells
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journal
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November 2015 |
Electron-phonon interactions from first principles
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journal
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February 2017 |
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
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journal
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April 2010 |
Theoretical and experimental study of temperature effect on electronic and optical properties of TiO2: Comparing rutile and anatase
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journal
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June 2020 |
Temperature dependence of semiconductor band gaps
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journal
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June 1991 |
Physical Properties of SnO[sub 2] Materials
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journal
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January 1976 |
First-Principles Investigations of the Temperature Dependence of Electronic Structure and Optical Properties of Rutile TiO 2
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journal
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September 2018 |
Ab Initio Force Constants of GaAs: A New Approach to Calculation of Phonons and Dielectric Properties
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journal
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February 1982 |
Sources of Electrical Conductivity in
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journal
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July 2008 |
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
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journal
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July 1996 |
Phonons and related crystal properties from density-functional perturbation theory
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journal
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July 2001 |
Isotope effects on the optical spectra of semiconductors
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journal
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November 2005 |
Highly uniform and vertically aligned SnO 2 nanochannel arrays for photovoltaic applications
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journal
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January 2015 |
High temperature fiber-optic evanescent wave hydrogen sensors using La-doped SrTiO3 for SOFC applications
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journal
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December 2015 |
Special points for Brillouin-zone integrations
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journal
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June 1976 |
Temperature dependence of the electronic structure of semiconductors and insulators
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journal
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September 2015 |
First principles phonon calculations in materials science
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journal
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November 2015 |
Theory of the temperature dependence of electronic band structures
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journal
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June 1976 |
A novel high-performance SnO2 catalyst for oxidative desulfurization under mild conditions
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journal
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August 2019 |
Quasiparticle energies and uniaxial pressure effects on the properties of SnO2
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journal
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December 2010 |
Linear optical properties in the projector-augmented wave methodology
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journal
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January 2006 |
DFT calculations of tin dioxide crystals containing heavily-doped fluorine
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journal
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December 2014 |
Harsh environment sensor development for advanced energy systems
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conference
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May 2013 |
SnO2: A comprehensive review on structures and gas sensors
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journal
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October 2014 |
Anharmonicity Explains Temperature Renormalization Effects of the Band Gap in SrTiO 3
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journal
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March 2020 |
First-principles exploration of oxygen vacancy impact on electronic and optical properties of ABO 3−δ (A = La, Sr; B = Cr, Mn) perovskites
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journal
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January 2020 |
Predominance of non-adiabatic effects in zero-point renormalization of the electronic band gap
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journal
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November 2020 |
Assessing the Effects of Temperature and Oxygen Vacancy on Band Gap Renormalization in LaCrO 3−δ : First-Principles and Experimental Corroboration
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journal
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April 2021 |
One-shot calculation of temperature-dependent optical spectra and phonon-induced band-gap renormalization
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journal
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August 2016 |
Tin Monoxide: Structural Prediction from First Principles Calculations with van der Waals Corrections
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journal
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September 2011 |
Fluorescence-based fibre optic arrays: a universal platform for sensing
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journal
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January 2003 |
Computed electronic and optical properties of SnO2 under compressive stress
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journal
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December 2014 |