First-Principles Screening of Structural, Electronic and Elastic Properties of Sr-Based Hydrides-Perovskites Sr X H3 (X = Ti, M n and Fe) for Hydrogen Storage Applications

Authors: Benaali, Hamza, Bahhar, Soufiane, Fatihi, Hmad, Tahiri, Abdellah, Naji, Mohamed, Abbassi, Abderrahman, Manaut, Bouzid

Source: 2024 4th International Conference on Innovative Research in Applied Science, Engineering and Technology (IRASET) Innovative Research in Applied Science, Engineering and Technology (IRASET), 2024 4th International Conference on. :01-05 May, 2024

Relation: 2024 4th International Conference on Innovative Research in Applied Science, Engineering and Technology (IRASET)

Revisiting the Effect of the Interatomic Potentials in the Simulated Calcium Silicate Glasses

Authors: El Kssiri, Othman, Naji, Mohamed, Tahiri, Abdellah, Filali, Mohammed

Source: 2024 4th International Conference on Innovative Research in Applied Science, Engineering and Technology (IRASET) Innovative Research in Applied Science, Engineering and Technology (IRASET), 2024 4th International Conference on. :1-8 May, 2024

Relation: 2024 4th International Conference on Innovative Research in Applied Science, Engineering and Technology (IRASET)

Lanthanum-doped BaTiO3 ceramics: Structural, dielectric, and ferroelectric properties

Authors: Moutaouaffiq, Adil ^{a, ⁎}, Belhajji, Mounir ^a, Didi Seddik, Ali ^a, Tahiri, Abdellah ^a, Ali, Enas ^b, Hajji, Lahoucine ^c, Rjeb, Abdelilah ^a, Paramasivam, Prabhu ^{d, h, ⁎}, Ghoneim, Sherif S.M. ^e, Sharaf, Ahmed B.Abou ^{f, g}

Source: In Results in Engineering March 2025 25

Impact of pressure on quaternary Heusler alloy LiScNiGe for optoelectronic application

Authors: Hrida, El Mustapha ^a, Bahhar, Soufiane ^b, Tahiri, Abdellah ^c, Idiri, Mohamed ^a, Touti, Rodouan ^{c, ⁎}, Jabar, Abderrahim ^{d, e}, Naji, Mohamed ^c

Source: In Materials Science in Semiconductor Processing July 2025 193

Structural and transport properties of lithium alumino-phosphate glass solid electrolytes: A molecular dynamics study

Authors: El Kssiri, Othman ^a, Tahiri, Abdellah ^a, Faik, Abdessamad ^b, Filali, Mohammed ^a, Naji, Mohamed ^{a, b, ⁎}

Source: In Computational Materials Science May 2025 253

Borophosphate glass based electrolyte composite for high lithium ionic conductivity

Authors: Chouiekh, Abdelhak ^a, El Hoda Bouftila, Nour ^a, Aqdim, Sara ^b, Bih, Lahcen ^c, Ababou, Yahya ^a, Tahiri, Abdellah ^a, Rjeb, Abdelilah ^a, Faik, Abdessamad ^d, Naji, Mohamed ^{a, d, ⁎}

Source: In Journal of Alloys and Compounds 5 January 2025 1010

Structural, optical, and electronic properties of cerium doped BaTiO3: Experimental study and DFT calculation

Authors: Didi Seddik, Ali ^{a, ⁎}, Chouiekh, Abdelhak ^a, Moutaouaffiq, Adil ^a, Masrour, Rachid ^b, Tahiri, Abdellah ^a, Rjeb, Abdelilah ^a, Naji, Mohamed ^{a, c}

Source: In Physica B: Condensed Matter 15 December 2024 695

Investigation of KMnH3 and KFeH3 perovskite hydrides via ab-initio for hydrogen storage

Authors: Benaali, Hamza, Bahhar, Soufiane, Tahiri, Abdellah, Didi, Youssef, Fatihi, Hmad, Abbassi, Abderrahman, Manaut, Bouzid, Naji, Mohamed

Source: In Inorganic Chemistry Communications November 2024 169

Experimental and DFT analysis of structural, optical, and electrical properties of Li3xLa2/3-xTiO3 (3x = 0.1, 0.3 and 0.5) solid electrolyte

Authors: Chouiekh, Abdelhak, Tahiri, Abdellah, El Hoda Bouftila, Nour, Nfissi, Aziz, Bih, Lahcen, Faik, Abdessamad, Lamcharfi, Taj-dine, Ababou, Yahya, Rjeb, Abdelilah, Naji, Mohamed

Source: Ceramics international. 49(15):25920-25934

Availability: http://explore.bl.uk/primo_library/libweb/action/display.do?tabs=detailsTab&gathStatTab=true&ct=display&fn=search&doc=ETOCvdc_100194173194.0x000001&indx=1&recIds=ETOCvdc_100194173194.0x000001

DFT‐Based Ab Initio Calculations of Structural, Electronic, Mechanical, and Optical Properties of Ga‐based Fluoroperovskite GaXF3 (X = Ca and Sr).

Authors: Karafi, Toufik, Hrida, El Mustapha, Idiri, Mohamed, Didi, Youssef, Tahiri, Abdellah, Touti, Rodouan, Naji, Mohamed

Source: ChemistrySelect; 3/26/2025, Vol. 10 Issue 12, p1-8, 8p

Subject Terms: BAND gaps, ELECTRONIC band structure, AB-initio calculations, ELASTICITY, LIGHT absorption

Computational insights into spin-polarized density functional theory applied to actinide-based perovskites XBkO₃ (X = Sr, Ra, Pb).

Authors: Didi, Youssef, Belhajji, Mounir, Bahhar, Soufiane, Tahiri, Abdellah, Naji, Mohamed, Rjeb, Abdelilah, Zaini, Hatim G., Flah, Aymen, Ghoneim, Sherif S. M., Sharaf, Ahmed B. Abou, Hashim, Mofreh A.

Source: Scientific Reports; 1/2/2025, Vol. 15 Issue 1, p1-15, 15p

Subject Terms: POISSON'S ratio, ELASTIC modulus, BULK modulus, BAND gaps, YOUNG'S modulus

Effect of Grain-Size in Nanocrystalline Tungsten on Hardness and Dislocation Density: A Molecular Dynamics Study.

Authors: Karafi, Toufik¹, karafi.toufik9@gmail.com, Tahiri, Abdellah², Chabba, Hanae³, Idiri, Mohamed¹, Boubeker, Brahim¹

Source: Crystals (2073-4352); Mar2023, Vol. 13 Issue 3, p469, 10p

Pressure-induced band gap shift and enhanced optical properties of quaternary Heusler TaAlCuCo: DFT study.

Authors: Hrida, El Mustapha., Bahhar, Soufiane., Tahiri, Abdellah., Naji, Mohamed, Idiri, Mohamed.

Source: Optical & Quantum Electronics; Sep2024, Vol. 56 Issue 9, p1-26, 26p

Subject Terms: METALLIC bonds, BAND gaps, LATTICE constants, REFRACTIVE index, OPTICAL properties

A Computational Study of Metal Hydrides Based on Rubidium for Developing Solid‐State Hydrogen Storage.

Authors: Didi, Youssef, Bahhar, Soufiane, Tahiri, Abdellah, Naji, Mohamed, Rjeb, Abdelilah

Source: ChemistrySelect; Jun2024, Vol. 9 Issue 22, p1-10, 10p

Subject Terms: HYDROGEN storage, RUBIDIUM, POISSON'S ratio, HYDRIDES, DENSITY functional theory, PHASE space

Structural Evolution of Intermetallic Phases β-Al3Mg2, γ-Al12Mg17 and ε-Al30Mg23 Using the Nanoindentation Process.

Authors: Taoufiki, Meryem¹, meryem04.taoufiki@gmail.com, Mes-adi, Hassane², El Harfouf, Amine³, Chabba, Hanae⁴, Tahiri, Abdellah⁵, Jouaiti, Ahmed¹, Herbazi, Rachid⁶

Source: Interdisciplinarity in Engineering; 2024, Vol. 2 Issue 1249, p107-120, 14p

Structural Evolution of Intermetallic Phases β-Al3Mg2, γ-Al12Mg17 and ε-Al30Mg23 Using the Nanoindentation Process.

Authors: Taoufiki, Meryem, Mes-adi, Hassane, El Harfouf, Amine, Chabba, Hanae, Tahiri, Abdellah, Jouaiti, Ahmed, Herbazi, Rachid

Source: Interdisciplinarity in Engineering; 2024, Vol. 2 Issue 1249, p107-120, 14p

Subject Terms: NANOINDENTATION, INTERATOMIC distances, MOLECULAR dynamics, ATOMS, CRYSTAL structure

A First‐Principles Study of Manganese‐Based Perovskite‐Type Hydrides for Hydrogen Storage Application.

Authors: Didi, Youssef¹ (AUTHOR), Bahhar, Soufiane² (AUTHOR), Tahiri, Abdellah¹ (AUTHOR) abdellah.tahiri@usmba.ac.ma, Naji, Mohamed¹ (AUTHOR), Rjeb, Abdelilah¹ (AUTHOR)

Source: Physica Status Solidi. A: Applications & Materials Science. Nov2024, p1. 11p. 7 Illustrations.

Subject Terms: *POISSON'S ratio, *HYDROGEN storage, *CLEAN energy, *ELASTIC constants, *DENSITY functional theory

Mechanicals Behaviors of Tungsten-Rhenium Alloy Single Crystals from 77K to 300K - Atomic Simulation Study

Authors: Tahiri, Abdellah, Idiri, Mohamed, Boubeker, Brahim

Source: International Journal of Engineering Research in Africa; September 2020, Vol. 50 Issue: 1 p177-181, 5p