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Work: Hybrid-DFT study of halide perovskites, an energy-efficient material under compressive pressure for piezoelectric applications

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Works cited by this work

Generalized Gradient Approximation Made Simple

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Density-functional exchange-energy approximation with correct asymptotic behavior

XCII. Relations between the elastic moduli and the plastic properties of polycrystalline pure metals

The SIESTA method for<i>ab initio</i>order-<i>N</i>materials simulation

Toward reliable density functional methods without adjustable parameters: The PBE0 model

On the stability of crystal lattices. I

<i>VESTA</i>: a three-dimensional visualization system for electronic and structural analysis

Advances in Lead-Free Piezoelectric Materials for Sensors and Actuators

First-principles Green's-function method for surface calculations: A pseudopotential localized basis set approach

Heat flow and lattice vibrations in glasses

Theory of polarization of crystalline solids

Lattice dynamics and elastic properties of Mg3As2 and Mg3Sb2 compounds from first-principles calculations

Nosé–Hoover chains: The canonical ensemble via continuous dynamics

Electronic, magnetic, vibrational, and X-ray spectroscopy of inverse full-Heusler Fe<sub>2</sub>IrSi alloy

Finite Deformations of an Elastic Solid

Electronic, mechanical, optical and piezoelectric properties of glass-like sodium silicate (Na<sub>2</sub>SiO<sub>3</sub>) under compressive pressure

Quantum‐mechanical condensed matter simulations with CRYSTAL

BSSE‐correction scheme for consistent gaussian basis sets of double‐ and triple‐zeta valence with polarization quality for solid‐state calculations

Lattice dynamics, mechanical stability and electronic structure of Fe-based Heusler semiconductors

A DFT study of electronic, optical and thermoelectric properties of Ge-halide perovskites CsGeX3 (X=F, Cl and Br)

Electrostrictive and Piezoelectric Materials for Actuator Applications

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Halide Perovskite Photovoltaics: Background, Status, and Future Prospects