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Работы, на которые ссылается эта работа

Работ: 89

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

  1. Generalized Gradient Approximation Made Simple

    John P. Perdew, Kieron Burke, Matthias Ernzerhof

    Статья1996Цитирований: 153
    ABI

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

    Chengteh Lee, Weitao Yang, Robert G. Parr

    Статья1988Цитирований: 84
    ABI

  3. Density-functional exchange-energy approximation with correct asymptotic behavior

    Axel D. Becke

    Статья1988Цитирований: 25
    ABI

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

    S.F. Pugh

    Статья1954Цитирований: 21
    ABI

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

    José M. Soler, Emilio Artacho, Julian D. Gale +4

    Статья2002Цитирований: 17
    ABI

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

    Carlo Adamo, Vincenzo Barone

    Статья1999Цитирований: 15
    ABI

  7. On the stability of crystal lattices. I

    Max Born

    Статья1940Цитирований: 11
    ABI

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

    Koichi Momma, Fujio Izumi

    Статья2008Цитирований: 9
    ABI

  9. Advances in Lead-Free Piezoelectric Materials for Sensors and Actuators

    Elena Aksel, Jacob L. Jones

    Обзорная статья2010Цитирований: 9
    ABI

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

    Søren Smidstrup, Daniele Stradi, Jess Wellendorff +7

    Статья2017Цитирований: 8
    ABI

  11. Heat flow and lattice vibrations in glasses

    David G. Cahill, R. O. Pohl

    Статья1989Цитирований: 7
    ABI

  12. Theory of polarization of crystalline solids

    R. D. King-Smith, David Vanderbilt

    Статья1993Цитирований: 7
    ABI

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

    Jun-ichi Tani, Masanari Takahashi, Hiroyasu Kido

    Статья2010Цитирований: 6
    ABI

  14. Nosé–Hoover chains: The canonical ensemble via continuous dynamics

    Glenn Martyna, Michael L. Klein, Mark E. Tuckerman

    Статья1992Цитирований: 6
    ABI

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

    Lalrinkima Lalrinkima, Chinedu E. Ekuma, Timothy C. Chibueze +4

    Статья2021Цитирований: 6
    ABI

  16. Finite Deformations of an Elastic Solid

    F. D. Murnaghan

    Статья1937Цитирований: 6
    ABI

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

    R. Zosiamliana, Lalrinkima Lalrinkima, B. Chettri +3

    СтатьяGlass properties and applicationsRSC Advances2022Цитирований: 6
    ABI

  18. Quantum‐mechanical condensed matter simulations with CRYSTAL

    Roberto Dovesi, Alessandro Erba, Roberto Orlando +8

    Статья2018Цитирований: 6
    ABI

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

    Daniel Vilela Oliveira, Joachim Laun, Michael F. Peintinger +1

    Статья2019Цитирований: 6
    ABI

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

    Shakeel Ahmad Khandy, Ishtihadah Islam, Dinesh C. Gupta +2

    Статья2019Цитирований: 5
    ABI

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

    Soukaina Bouhmaidi, Adil Marjaoui, Abdelali Talbi +3

    Статья2022Цитирований: 5
    ABI

  22. Electrostrictive and Piezoelectric Materials for Actuator Applications

    Dragan Damjanović, Robert E. Newnham

    Статья1992Цитирований: 5
    ABI

  23. Piezoelectric Biomaterials for Sensors and Actuators

    Meysam T. Chorsi, Eli Curry, Hamid T. Chorsi +5

    Обзорная статья2018Цитирований: 5
    ABI

  24. Theoretical investigation of the bonding and elastic properties of nanolayered ternary nitrides

    Zhimei Sun, Denis Mušić, Rajeev Ahuja +1

    Статья2005Цитирований: 4
    ABI

  25. Halide Perovskite Photovoltaics: Background, Status, and Future Prospects

    Ajay Kumar Jena, Ashish Kulkarni, Tsutomu Miyasaka

    Обзорная статья2019Цитирований: 4
    ABI