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25 ta ish

Ish: Investigation of the structural, electronic, magnetic, mechanical, and optical properties of calcium-based CaJO3 (J = Mn, Ru) perovskites: A first-principle computations

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    John P. Perdew, Kieron Burke, Matthias Ernzerhof

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  2. Self-Consistent Equations Including Exchange and Correlation Effects

    W. Kohn, L. J. Sham

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  3. The Compressibility of Media under Extreme Pressures

    F. D. Murnaghan

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  4. Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential

    Fabien Tran, Peter Blaha

    Maqola200935 iqtibos
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  5. XCII. Relations between the elastic moduli and the plastic properties of polycrystalline pure metals

    S.F. Pugh

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  6. Necessary and sufficient elastic stability conditions in various crystal systems

    Félix Mouhat, François‐Xavier Coudert

    MaqolaOchiq kirish201419 iqtibos
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  7. Efficient linearization of the augmented plane-wave method

    Georg K. H. Madsen, Peter Blaha, Karlheinz Schwarz +2

    Maqola200111 iqtibos
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  8. Thermophysical Properties of Materials

    H.-J. Fecht, R. Wunderlich, L. Battezzati +4

    Kitob19995 iqtibos
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  9. First principles study on the electronic and optical properties of B-site ordered double perovskite Sr2MMoO6 (M=Mg, Ca, and Zn)

    Shuai Zhao, Chunfeng Lan, Jie Ma +3

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  10. WIEN2k: An Augmented Plane Wave Plus Local Orbitals Program for Calculating Crystal Properties

    Peter Blaha, Karlheinz Schwarz, Georg K. H. Madsen +5

    Maqola20194 iqtibos
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  11. A2B′B″O6 perovskites: A review

    Sami Vasala, Maarit Karppinen

    Sharh maqola20144 iqtibos
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  12. First‐Principles Calculations to Investigate the Refractive Index and Optical Dielectric Constant of Na<sub>3</sub>Sb<i>X</i><sub>4</sub> (<i>X</i> = S, Se) Ternary Chalcogenides

    Y. Al‐Douri, M. Ameri, A. Bouhemadou +1

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  13. Sarlavhasiz

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  14. Improved tetrahedron method for Brillouin-zone integrations

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  15. First-principles calculations of pressure and temperature dependence of thermodynamic properties of anti-perovskite BiNBa 3 compound

    Kada Bidai, M. Ameri, Amel Slamani +4

    Maqola20172 iqtibos
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  16. Electronic and thermoelectric properties of the layered BaFAg Ch ( Ch  = S, Se and Te): First-principles study

    Kaouthar Boudiaf, A. Bouhemadou, Y. Al‐Douri +3

    Maqola20182 iqtibos
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  17. Structural and Electronic Properties of Inorganic Mixed Halide Perovskites

    Xuejiao Chen, Dong Han, Ying Su +3

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  18. Generalization of intrinsic ductile-to-brittle criteria by Pugh and Pettifor for materials with a cubic crystal structure

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  19. Sarlavhasiz

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