361 citations · 637 across the 20 of their papers we have counts for
20 papers
Enhanced Emission from Boron-Vacancy Center in Rhombohedral Boron Nitride
Nasrin Estaji, Ismaeil Abdolhosseini Sarsari, Gergő Thiering +1
Boron nitride is a layered crystal whose properties depend on how its atomic sheets are stacked. Its negatively charged boron vacancy is a well-established magnetic defect that can…
Spin-Phonon Relaxation of Boron-Vacancy Centers in Two-Dimensional Boron Nitride Polytypes
Nasrin Estaji, Ismaeil Abdolhosseini Sarsari, Gergő Thiering +1
Two-dimensional (2D) materials hosting color centers and spin defects are emerging as key platforms for quantum technologies. However, the impact of reduced dimensionality on the s…
Vacancy-related color centers in twodimensional silicon carbide monolayers
M. Mohseni, I. Abdolhosseini Sarsari, S. Karbasizadeh +4
Basic vacancy defects in twodimensional silicon carbide (2D-SiC) are examined by means of density functional theory calculations to explore their magneto-optical properties as well…
Response to "Comment on 'A novel two-dimensional boron-carbon-nitride (BCN) monolayer: A first-principles insight [J. Appl. Phys. 2021, 130, 114301]'"
Asadollah Bafekry, Mosayeb Naseri, Mohamed M. Fadlallah +5
Recently, reported a comments on the our paper [JAP21-AR-03574R].. For clarification, we applied the fingerprint theory to examine the similarity between the distinct structures. T…
Response to Comment on (Novel two-dimensional porous graphitic carbon nitride C6N7 monolayer: A First-principle calculations [Appl. Phys. Lett. 2021, 119, 142102])
Asadollah Bafekry, Mehrdad Faraji, Mohamed M. Fadlallah +4
Recently, reported a comments on the our paper [Appl. Phys. Lett. 119, 142102 (2021)]. With our response, the APL journal rejected their non scientific comments. There are some amb…
AlB and AlB monolayers: emergence of multiple two-dimensional Dirac nodal line semimetals with novel properties
Saeid Abedi, Esmaeil Taghizadeh Sisakht, S. Javad Hashemifar +3
Topological semimetal phases in two-dimensional (2D) materials have gained widespread interest due to their potential applications in developing nanoscale devices. Despite the pred…
Two-dimensional pentagonal material Penta-PdPSe: A first-principle study
A. Bafekry, M. M. Fadlallah, M. Faraji +5
Low-symmetry Penta-PdPSe with intrinsic in-plane anisotropy synthesized successfully [(P. Li et al., Adv. Mater., 2102541, (2021)]. Motivated by this experimental discovery, we inv…
Tunable Ohmic contact in graphene/HfS van der Waals heterostructure
S. Karbasizadeh, F. Fanaeiparvar, I. Abdolhosseini Sarsari
With the use of density functional theory calculations and addition of van der Waals correction, the graphene/HfS heterojunction is constructed, and its electronic properties a…
Theoretical study of quantum emitters in two-dimensional silicon carbide monolayer
Q. Hassanzada, I. Abdolhosseini Sarsari, A. Hashemi +3
The features of some potential single-photon sources in two-dimensional silicon carbide monolayers is studied via ab-initio calculation and group theory analysis. A few point defec…
Direct band gap in gallium sulfide nanostructures
M. Mosaferi, I. Abdolhosseini Sarsari, M. Alaei
The monolayer Gallium sulfide (GaS) was demonstrated as a promising two-dimensional semiconductor material with considerable band gaps. The present work investigates the band gap m…
Gas molecules (CO, NH, CO) sensing with Polyaniline Emardline salt (PANI ES) : a turbo TDDFT study
N. Hadian Jazi, I. Abdolhosseini Sarsari, N. Zare Dehnavi
The adsorption of gas molecules (CO, NH, CO ) on Polyaniline Emeraldine salt has been performed to study gas sensing. Density functional theory (DFT) and time dependent den…
Graphyne as the anode material of magnesium-ion batteries: ab initio study
E. Shomali, I. Abdolhosseini Sarsari, F. Tabatabaei +2
Graphyne, a single atomic layer structure of the carbon six-member rings connected by one acetilenic linkage, is a promising anode of rechargeable batteries. In this paper, a first…
Quantum conductance of MoS_2 armchair nanoribbons
F. Tabatabaei, I. Abdolhosseini Sarsari, N. Rezaei +1
Molybdenum disulfide (MoS2) is layered transition-metal dichalcogenide (TMDC), which in its monolayer form, has the direct bandgap of 1.8 eV. We investigated the effect of width an…
Calculated Structural and Electronic Interactions of the nano dye molecule () with a iodide/triiodide redox shuttle
E. Shomali, I. Abdolhosseini Sarsari, S. Javad Hashemifar +1
In this paper, dye sensitized solar cell based on nano dye molecule N3 are investigated by using density functional computations. The main focus is on the N3 dye molecule and corre…
Influence of Al-doping on the structural, magnetic, and electrical properties of LaBaMnAlO () manganites
J. Ardashti Saleh, I. Abdolhosseini Sarsari, P. Kameli +1
We have studied the effect of Al doping on the structural, magnetic and electrical properties of LaBaMnAlO () manganite, annealed in…
Highly Anistoropic Thermal Conductivity of Arsenene: An ab initio Study
M. Zeraati, S. M. Vaez Allaei, I. Abdolhosseini Sarsari +2
Elemental 2D materials exhibit intriguing heat transport and phononic properties. Here we have investigated the lattice thermal conductivity of newly proposed arsenene, the 2D hone…
Comment on "Semiconducting Layered Blue Phosphorus: A Computational Study"
I. Abdolhosseini Sarsari, Z. Allahyari, M. Alaei +1
\noindent Using results drawn from the pages of PRL\cite{Zhu2014}, the authors comment on \textquotedblleft Semiconducting Layered Blue Phosphorus: A Computational Study\textquoted…
Effect of Ag doping on structural, optical, and photocatalytic properties of ZnO nanoparticles
S. M. Hosseini, I. Abdolhosseini Sarsari, P. Kameli +1
Silver-doped ZnO nanoparticles were successfully fabricated at via a simple and rapid method based on short time solid state milling and calcination of pr…
Electronic structure of Co doped ZnO from the \textit{GW} perspective
I. Abdolhosseini Sarsari, C. D. Pemmaraju, H. Salamati +1
In transition metal doped ZnO, the energy position of dopant 3 states relative to host conduction and valence bands is crucial in determining the possibilty of long range ferrom…
First-principles study of structural, electronic and thermodynamic properties of (ZnO)(n=2-16) clusters
I. Abdolhosseini Sarsari, S. Javad Hashemifar, Hadi Salamati +1
The structural, electronic, and vibrational thermodynamic properties of the (ZnO) (n=2-16) clusters are studied using density functional - full potential computations. The resu…