Zobrazeno 1 - 10
of 11
pro vyhledávání: '"Mohsin K. Al-Khaykanee"'
Autor:
Rajaa K. Mohammad, Mohammad R. Mohammad, Mohsin K. Al-Khaykanee, Duha S. Ahmed, Luma M. Ahmed
Publikováno v:
NeuroQuantology. 20:298-303
The electronic properties of carbon nanotubes CNTs, such as ionization potential (IP), electron affinity (EA), energy gap (Eg), Fermi energy (Ef), binding energy (Eb), the density of state (DOS), and IR spectral properties, investigated after substit
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4956458726cd9f0611250af27a89b19c
https://doi.org/10.14704/nq.2022.20.5.nq22174
https://doi.org/10.14704/nq.2022.20.5.nq22174
Autor:
Mohsin K. Al-Khaykanee, Ali Al-Jawdahb
Publikováno v:
Iraqi Journal of Physics (IJP). 19:70-76
The present work shows a theoretical results that have been used the functional Hybrid of three parameters Lee-Yang-Parr (B3LYP) of the quantum mechanical approach for density functional theory with (Spanish Initiative for Electronic Simulations with
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f2129d1a9aecf7db3234d675065aa165
https://doi.org/10.30723/ijp.v19i50.658
https://doi.org/10.30723/ijp.v19i50.658
Publikováno v:
1ST SAMARRA INTERNATIONAL CONFERENCE FOR PURE AND APPLIED SCIENCES (SICPS2021): SICPS2021.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d8edefdc36fc3818ab4998bf7499d78d
https://doi.org/10.1063/5.0121153
https://doi.org/10.1063/5.0121153
When a linear aromatic molecule within a nanogap is bound only to a source electrode, and an adjacent molecule is bound only to a drain electrode, the two molecules can interactviapi–pi stacking, which allows electrons to flow from the source to th
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od______2659::4020a581ad8226a834734db9c635a1b0
https://zenodo.org/record/2613596
https://zenodo.org/record/2613596
Autor:
Richard J. Nichols, Saman Naghibi, Zheng X, Donald Bethell, Colin J. Lambert, Ali K. Ismael, Andrea Vezzoli, Simon J. Higgins, Mohsin K. Al-Khaykanee, Iain Grace
Control of quantum interference features: molecular junctions incorporating pyrrolodipyridine-based molecular wires were fabricated by scanning probe methods. Quantum interference effects were introduced by employing meta-connected molecules, and mod
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::79562527e017f54d003bd0f6103ca76f
https://doi.org/10.26434/chemrxiv.7667495
https://doi.org/10.26434/chemrxiv.7667495
Autor:
Faeq A. AL-Temimei, Hamid I. Abbood, Dhay Ali Sabur, Alaa A. Al-Jobory, Mohsin K. Al-Khaykanee
Publikováno v:
THE 7TH INTERNATIONAL CONFERENCE ON APPLIED SCIENCE AND TECHNOLOGY (ICAST 2019).
DFT method was used to investigate the conductivities and thermoelectric properties for platinum metal complexes. The results were showed the type of ligands in the molecular complexes, which play a significant role in electrical and thermal properti
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::edad002dbd4129f235a2609df7b4ea69
https://doi.org/10.1063/1.5123090
https://doi.org/10.1063/1.5123090
Autor:
Xijia Zheng, Ali K. Ismael, Simon J. Higgins, Richard J. Nichols, Iain Grace, Mohsin K. Al-Khaykanee, Andrea Vezzoli, Colin J. Lambert, Donald Bethell, Saman Naghibi
Publikováno v:
The Journal of Physical Chemistry Letters
A key area of activity in contemporary molecular electronics is the chemical control of conductance of molecular junctions and devices. Here we study and modify a range of pyrrolodipyridines (carbazole-like) molecular wires. We are able to change the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::422cac2f65ecfd242167faec9100aac1
Publikováno v:
IOP Conference Series: Materials Science and Engineering. 928:072034
The current work involved suggestion of a new material “D-π-A system” for use in solar cells as organic dyes sensitized. The ground state estimations are done by utilizing the hybrid functional “B3LYP” with 6-311G(d, p) basis set on density
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d9b2b2af74260736d28390496e8cf73f
https://doi.org/10.1088/1757-899x/928/7/072034
https://doi.org/10.1088/1757-899x/928/7/072034
Autor:
Ali Khalid Ismael, Kun Wang, Andrea Vezzoli, Mohsin K. Al‐Khaykanee, Harry E. Gallagher, Iain M. Grace, Colin J. Lambert, Bingqian Xu, Richard J. Nichols, Simon J. Higgins
Publikováno v:
Angewandte Chemie
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::bc0b6e2d8755833d354f4089db623f5b
http://livrepository.liverpool.ac.uk/3015065/1/Manuscript_BiPY_Tuneable_Switch_Accepted_article.pdf
http://livrepository.liverpool.ac.uk/3015065/1/Manuscript_BiPY_Tuneable_Switch_Accepted_article.pdf
Autor:
Harry E. Gallagher, Andrea Vezzoli, Iain Grace, Mohsin K. Al-Khaykanee, Simon J. Higgins, Kun Wang, Bingqian Xu, Ali K. Ismael, Richard J. Nichols, Colin J. Lambert
Publikováno v:
Angewandte Chemie (International Edition)
A key target in molecular electronics has been molecules having switchable electrical properties. Switching between two electrical states has been demonstrated using such stimuli as light, electrochemical voltage, complexation and mechanical modulati
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e5a437458cec7e051a8dceda019a2e1d