Image de couverture de livre

First-principles investigation of the physical properties of wide band gap hexagonal AlPO4 compound for possible applications

Fuente: arXiv

Enregistré dans:

Détails bibliographiques
Auteurs principaux:	Reza, A. S. M. Muhasin, Afzal, Md. Asif, Naqib, S. H.
Format:	Preprint
Publié:	2024
Sujets:	Materials Science
Accès en ligne:	Acceder al recurso
Tags:	Ajouter un tag Pas de tags, Soyez le premier à ajouter un tag!

Documents similaires

Pressure dependent ab initio study of the physical properties of hexagonal BeB2C: a possible high-Tc superconductor
par: Ali, Ruman, et autres
Publié: (2025)

First-principles exploration of the pressure dependent physical properties of Sn4Au: a superconducting topological semimetal
par: Shah, M. Abdul Hadi, et autres
Publié: (2024)

Pressure dependent physical properties of a potential high-TC superconductor ScYH6: insights from first-principles study
par: Alam, Md. Ashraful, et autres
Publié: (2024)

Structural Chirality and Natural Optical Activity across the $α$-to-$β$ Phase Transition in SiO$_2$ and AlPO$_4$ from first-principles
par: Gómez-Ortiz, F., et autres
Publié: (2025)

Ab-initio insights into the mechanical, phonon, bonding, electronic, optical and thermal properties of hexagonal W2N3 for potential applications
par: Ahmed, Istiak, et autres
Publié: (2024)

DFT based comparative study of the physical properties of MAlB (M = V, Ta, Mo, Nb) MAB compounds
par: Hassan, Jahid, et autres
Publié: (2025)

Ferroelectric metal-organic frameworks as wide band gap materials
par: Shaikh, Monirul, et autres
Publié: (2025)

Physical properties of transition metal hydride superconductors Mg2TmH6 (Tm = Rh, Pd, Ir, Pt) by first-principles calculations
par: Alam, Md Ashraful, et autres
Publié: (2026)

DFT based comparative analysis of physical properties of binary metallic diborides XB$_2$ (X = Cr, Mo and W)
par: Ahmed, Razu, et autres
Publié: (2024)

First-principles insights into the optoelectronic and thermoelectric properties of X3NbY4(X= Cu, Ag, Au; Y=S, Se, Te) sulvanite compounds for energy applications
par: Emo, Sadeya Sabnam, et autres
Publié: (2026)

First-principles theory of direct-gap optical emission in hexagonal Ge and its enhancement via strain engineering
par: Broderick, Christopher A., et autres
Publié: (2024)

DFT exploration of novel direct band gap semiconducting halide double perovskites, A2AgIrCl6 (A = Cs, Rb, K), for solar cells application
par: Rayhan, M. A., et autres
Publié: (2024)

A detailed first-principles study of the structural, elastic, thermomechanical and optoelectronic properties of binary rare-earth tritelluride NdTe3
par: Chowdhury, Tanbin, et autres
Publié: (2024)

DFT exploration of pressure dependent physical properties of the recently discovered La3Ni2O7 superconductor
par: Haque, Md. Enamul, et autres
Publié: (2025)

Pressure dependent topological, superconducting, optoelectronic and thermophysical properties of Ta2Se chalcogenide: Theoretical insights
par: Rahman, Tauhidur, et autres
Publié: (2026)

Emerging ultra-wide band gap semiconductors for future high-frequency electronics
par: Garrity, Emily M., et autres
Publié: (2025)

One-step synthesis of Cu-doped Pb$_{10}$(PO$_{4}$)$_{6}$Cl$_{2}$ apatite: A wide-gap semiconductor
par: Yang, W. Z., et autres
Publié: (2024)

Multiplet structure of chromium(III) dopants in wide band gap materials
par: Popov, Ilya, et autres
Publié: (2025)

First-principles characterization of thermal conductivity in LaPO4-based alloys
par: Pazhedath, Anees, et autres
Publié: (2023)

Flat bands in ultra-wide gap two-dimensional germanium dioxide
par: Reis, Rafael Franco Ribeiro, et autres
Publié: (2025)

Exploring the Physical Properties, Hydrogen Storage Capacity and Thermal Barrier Performance of LaMg2H7: A First-Principles Investigation
par: Khan, Tanvir, et autres
Publié: (2025)

First-principles methodology for studying magnetotransport in narrow-gap semiconductors: an application to Zirconium Pentatelluride ZrTe5
par: Pi, Hanqi, et autres
Publié: (2024)

Structural and Gas Permeation Properties of Pebax/ AlPO 4 ‐5 Mixed Matrix Membrane
par: Nasim Abbasi, et autres
Publié: (2025)

First-principle investigation of the electronic structure and optical properties of graphene/boron nitride lateral heterostructures
par: Richaud, Elisa Serrano, et autres
Publié: (2025)

First-principles band alignment engineering in polar and nonpolar orientations for wurtzite AlN, GaN, and B$_x$Al$_{1-x}$N alloys
par: Milne, Cody L, et autres
Publié: (2025)

First-principles high-throughput screening of ruthenium compounds for advanced interconnects
par: Maeng, Gyungho, et autres
Publié: (2026)

Ab-initio Study of Structural, Magnetic, Optoelectronic and Thermo-Physical Properties of HoPdBi Half-Heusler Semimetal
par: Khan, Tanvir, et autres
Publié: (2025)

A possible superconducting gap signature with filling temperature around 40 K in hexagonal iron telluride islands
par: He, Guanyang, et autres
Publié: (2026)

First-principles study of optoelectronic and thermoelectronic properties of the ScAgC half-Heusler compound
par: Solet, Vinod Kumar, et autres
Publié: (2022)

Thermal Catalytic Degradation of Sulfur Hexafluoride by AlPO 4 /γ‐Al 2 O 3 ‐Loaded Catalysts
par: Jingxiang Ma, et autres
Publié: (2025)

First-principles study of phase stability and magnetic properties of B2 AlCr, AlMn, AlFe, AlCo and AlNi aluminides
par: Aihemaiti, Haireguli, et autres
Publié: (2025)

First principles investigation of phase stability in the B-Pt alloy system
par: Widom, Michael
Publié: (2024)

Formation and protection of an Eu-Ir surface compound below hexagonal boron nitride
par: Bakhit, Alaa Mohammed Idris, et autres
Publié: (2025)

First-Principles Investigation of the Pressure Dependent Physical Properties of Intermetallic Kagome ZrRe2
par: Naher, Mst. Irin, et autres
Publié: (2026)

Unambiguous identification of the indirect band nature of atomically thin hexagonal boron nitride
par: Fu, Lei, et autres
Publié: (2024)

Determination of crystal structure and physical properties of Ru2Al5 intermetallic from first-principles calculations
par: Luo, Jing, et autres
Publié: (2024)

First principles phase diagram calculation and theoretical investigation of electronic structure properties of $\mathrm{KCuTe_{1-x}Se_{x}}$ for photocathode applications
par: Kar, Arini, et autres
Publié: (2025)

Narrowing band gap chemically and physically: Conductive dense hydrocarbon
par: Nakagawa, Takeshi, et autres
Publié: (2024)

First-principles study of infrared, Raman, piezoelectric and elastic properties of Mg-IV-N\textsubscript{2} (IV = Ge, Si, Sn)
par: Sadman, Sarker Md., et autres
Publié: (2026)

First-principles investigation of small polarons in rhombohedral NaNbO$_{3}$
par: Amirabbasi, Mohammad, et autres
Publié: (2026)