Analytical First Principles Investigation of rare earth spinel chalcogenides BaGd(2)X(4) (X = S, Se) to explore the varying DFT potentials impacts on mechanical, optoelectronic, thermoelectric and thermodynamic response of the materials.
- DOI
- 10.1016/j.jmgm.2026.109617
- Published
- 2026 Oct 15
- Container
- Journal of molecular graphics & modelling
- Publisher
- Not recorded
- Open access
- no
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BibTeX
@article{allodium:10.1016/j.jmgm.2026.109617,
title = {Analytical First Principles Investigation of rare earth spinel chalcogenides BaGd(2)X(4) (X = S, Se) to explore the varying DFT potentials impacts on mechanical, optoelectronic, thermoelectric and thermodynamic response of the materials.},
author = {Mubashar S and Yasir MA and Bourezgui A and Saeed U and Ahsan M and Ali K},
year = {2026},
journal = {Journal of molecular graphics \& modelling},
doi = {10.1016/j.jmgm.2026.109617},
url = {https://doi.org/10.1016/j.jmgm.2026.109617}
}RIS
TY - JOUR TI - Analytical First Principles Investigation of rare earth spinel chalcogenides BaGd(2)X(4) (X = S, Se) to explore the varying DFT potentials impacts on mechanical, optoelectronic, thermoelectric and thermodynamic response of the materials. AU - Mubashar S AU - Yasir MA AU - Bourezgui A AU - Saeed U AU - Ahsan M AU - Ali K PY - 2026 JO - Journal of molecular graphics & modelling DO - 10.1016/j.jmgm.2026.109617 UR - https://doi.org/10.1016/j.jmgm.2026.109617 ER -
APA
S, M., MA, Y., A, B., U, S., M, A., & K, A. (2026). Analytical First Principles Investigation of rare earth spinel chalcogenides BaGd(2)X(4) (X = S, Se) to explore the varying DFT potentials impacts on mechanical, optoelectronic, thermoelectric and thermodynamic response of the materials.. Journal of molecular graphics & modelling. https://doi.org/10.1016/j.jmgm.2026.109617
Source records
- pubmed · retrieved 2026-11-10T12:59:23.220Z
- europe-pmc · retrieved 2026-11-10T12:59:23.225Z