Zobrazeno 1 - 10
of 33
pro vyhledávání: '"M. Imran Jamil"'
Publikováno v:
High Temperatures-High Pressures. 51:179-194
In this article, we have used density functional theory to investigate the pressure dependent structural, elastic, thermal and electronic properties of LaMO3 (M = Al, Ga, Ti and V) compounds. Optimized structural attributes suggest all compounds are
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d129be783598cd34bfbdbb2b36f7ae6b
https://doi.org/10.32908/hthp.v51.1129
https://doi.org/10.32908/hthp.v51.1129
Autor:
Junaid Munir, M Khuram Iftikhar, M Imran Jamil, Moeen Ud Din, Thamraa Alshahrani, H I Elsaeedy, Quratul Ain
Publikováno v:
Physica Scripta. 98:065513
Spin-polarized calculations of mechanical, electronic structure, phonon, optical and magnetic properties of AcXO3 (X = Cr, Fe) perovskite oxides (POs) has been computed using the full-potential linearized augmented plane wave method. The modified Bec
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::29f5691c68e66d8926a949ead2ac4863
https://doi.org/10.1088/1402-4896/accf4a
https://doi.org/10.1088/1402-4896/accf4a
Publikováno v:
High Temperatures-High Pressures. 48:399-411
In the enclosure of density functional theory along with GGA (generalized gradient approximation), incorporated in Wien2k code has been utilized to explore structural, electronic and mechanical properties of SrNbO3 (SNO). It has been found that spin-
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::bd255510fdbee966de3fbc31df08c1dc
https://doi.org/10.32908/hthp.v48.763
https://doi.org/10.32908/hthp.v48.763
Publikováno v:
ECS Journal of Solid State Science and Technology. 12:013003
In this work, structural, electronic, magnetic, thermal and mechanical properties of Mn2ZrZ (Z=Ge and Si) under pressure up to 50 GPa is studied using state of the art density functional theory. In structural properties, under pressure ground state o
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5c6721b072f792082a8ddcf2749d81b9
https://doi.org/10.1149/2162-8777/acaf18
https://doi.org/10.1149/2162-8777/acaf18
Publikováno v:
Journal of Electronic Materials. 48:5323-5327
Reststrahlen band measurements in RuCrX (X = Si, Ge, Sn) Half Heusler Alloys (HHAs) for Far Infrared (FIR) spectroscopy are pointed out in this article by using Density Functional Theory (DFT). Generalized Gradient Approximation (GGA) as an exchange
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c05130fe45b5748cd74ded5a5a03e9c3
https://doi.org/10.1007/s11664-019-07342-z
https://doi.org/10.1007/s11664-019-07342-z
Autor:
Kinza Riaz, Sohail Nadeem, Amani Chrouda, Shahid Iqbal, Ayesha Mohyuddin, Sadaf Ul Hassan, Mohsin Javed, Amal BaQais, Nissren Tamam, Komal Aroosh, Abdul Rauf, Mohammed A.S. Abourehab, M. Imran Jamil, Eslam B. Elkaeed, Rami M. Alzhrani, Nasser S. Awwad, Hala A. Ibrahium
Publikováno v:
Colloids and Surfaces A: Physicochemical and Engineering Aspects. 649:129332
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c125cc6744188812877ab5977be5f473
https://doi.org/10.1016/j.colsurfa.2022.129332
https://doi.org/10.1016/j.colsurfa.2022.129332
Autor:
Ayash O. Alrashdi, Saad Tariq, M. Imran Jamil, A.A. Mubarak, Muhammad Saleem, S.M. Sohail Gilani, H.H. Somaily, Nazar Hussain, Saleh Al-Omari
Publikováno v:
Polyhedron. 220:115796
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5a1e516ab1f2384c43b7d4c7331304ff
https://doi.org/10.1016/j.poly.2022.115796
https://doi.org/10.1016/j.poly.2022.115796
Publikováno v:
The European Physical Journal A. 56
We calculate the cross sections for the processes $$\rho J/\psi \rightarrow D^0 \bar{D}^0$$, $$\rho J/\psi \rightarrow D^0\bar{D}^{0*}$$ ($$D^{0*}\bar{D}^{0}$$) and $$\rho J/\psi \rightarrow D^{0*}\bar{D}^{0*}$$ by modifying the usual sum of two-body
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::83cc69d73c728c79c0268e349683c223
https://doi.org/10.1140/epja/s10050-020-00067-2
https://doi.org/10.1140/epja/s10050-020-00067-2
Publikováno v:
Chinese Journal of Physics. 56:1481-1487
Under pressure KNbO3 has been studied for its structural, electronic and mechanical properties by using state of the art density functional theory. Elastic stability criterion and structural optimizations show stable cubic phase, up to 150 GPa, of th
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::66461fbd3ffd8696331f6df9bfcb0220
https://doi.org/10.1016/j.cjph.2018.06.003
https://doi.org/10.1016/j.cjph.2018.06.003
Publikováno v:
Chinese Journal of Physics. 56:308-314
Generalized gradient approximation and Modified Becke and Johnson (mBJ) potential scheme, within density functional theory, has been implemented to evaluate the structural, electronic and thermo-elastic attributes of SrTcO3. The structural stability
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::87f6d6b9ea0acc481c6309d2bc302c93
https://doi.org/10.1016/j.cjph.2018.01.002
https://doi.org/10.1016/j.cjph.2018.01.002