Zobrazeno 1 - 10
of 239
pro vyhledávání: '"F. Parvin"'
Publikováno v:
Heliyon, Vol 10, Iss 13, Pp e33613- (2024)
We thoroughly investigated the structural, mechanical, electronic, vibrational, optical, thermodynamic, and a number of thermophysical properties of W2N3 compound through first-principles calculations using the DFT based formalism. The calculated str
Externí odkaz:
https://doaj.org/article/d8a837259c2247c987b2329741c9e919
Publikováno v:
Results in Physics, Vol 58, Iss , Pp 107498- (2024)
Using the density functional theory (DFT) based first-principles investigation, the structural, mechanical, hardness, elastic anisotropy, optoelectronic, thermophysical and superconducting properties of cubic KB2H8 have been studied within the unifor
Externí odkaz:
https://doaj.org/article/5057fc1191104680b7766826818a859e
Publikováno v:
Results in Materials, Vol 21, Iss , Pp 100500- (2024)
Binary uranium hydrides, UHx (x = 1, 2, 3, 5, 6, 7, 8), with different crystal symmetries are potentially interesting compounds for high-Tc superconductivity and as hydrogen storage systems. In this work we have explored the structural, elastic, mech
Externí odkaz:
https://doaj.org/article/6b88fe13e02640a69a31e930470d7680
Publikováno v:
Results in Physics, Vol 52, Iss , Pp 106921- (2023)
In recent times transition metal ternary borides with layered structure have attracted much attention of the materials science community. In this study, we have used density functional theory (DFT) based first-principles investigation of the physical
Externí odkaz:
https://doaj.org/article/8dac65cb4f5447fb8f74187b7f259d1b
Elastic, electronic, optical, and thermodynamic properties of M2SeC (M = Hf, Zr) under high pressure
Publikováno v:
AIP Advances, Vol 13, Iss 2, Pp 025154-025154-16 (2023)
The physical properties of the synthesized MAX phases M2SeC (M = Hf, Zr) have been investigated for the first time using the DFT method in the pressure range 0–25 GPa. The computed lattice parameters are consistent with the earlier findings at ambi
Externí odkaz:
https://doaj.org/article/c67f49b3e99e4e3ab66f32b96a007cf0
Publikováno v:
Journal of Materials Research and Technology, Vol 11, Iss , Pp 1969-1981 (2021)
Inherent and modified characteristics of MAX phase materials are important for technological applications in different fields. From this point of view, the present article gives a brief overview of the physical properties of Nb2SC1-xBx (x = 0.0–1.0
Externí odkaz:
https://doaj.org/article/2cb9d47f13a64e24b4e8007ceece6444
Publikováno v:
Results in Physics, Vol 23, Iss , Pp 104068- (2021)
We have explored the mechanical, electronic, optical and thermoelectric properties of p-type half-Heusler compound BaAgP for the first time using density functional theory based calculations. Our calculated lattice parameters are in good agreement wi
Externí odkaz:
https://doaj.org/article/0a02824df79f4efd8755980e2f5d0a4f
Autor:
F. Parvin, S.H. Naqib
Publikováno v:
Results in Physics, Vol 21, Iss , Pp 103848- (2021)
NaSn2P2 is a recently discovered superconducting system belonging to a particular class of materials with van der Waals (vdW) structure. There is enormous interest in vdW compounds because of their intriguing electrical, optical, chemical, thermal, a
Externí odkaz:
https://doaj.org/article/8d33b34fc34a4541aff760eb7e2b5237
Publikováno v:
Results in Physics, Vol 7, Iss , Pp 3634-3639 (2017)
This article reports the first-principles calculations of yet unexplored Mulliken bond population, Vickers hardness, thermodynamic and optical properties of MAX phases V2AC (A = Al, Ga). We have also revisited the structural and elastic properties of
Externí odkaz:
https://doaj.org/article/ef3793a15e9140d88ac0b40bf4ce2916
Publikováno v:
Journal of Engineering, Vol 2018 (2018)
Students spend a large portion of their time in school. In this broadened time of sitting, poor fitting furniture can cause various types of musculoskeletal disorders and discomforts. Thus, it is crucial to use anthropometric data to coordinate the a
Externí odkaz:
https://doaj.org/article/c3301b8f43f5467a84f9efe39e033c36