I. Muz

发表

DFT and TD-DFT studies of new pentacene-based organic molecules as a donor material for bulk-heterojunction solar cells

Mehmet M. Dalkilic, I. Muz, M. Kurban, 2020 .

3d-transition metals (Cu, Fe, Mn, Ni, V and Zn)-doped pentacene π-conjugated organic molecule for photovoltaic applications: DFT and TD-DFT calculations

I. Muz, M. Kurban, Fahrettin Göktaş, 2020, Theoretical Chemistry Accounts.

A first-principles evaluation on the interaction of 1,3,4-oxadiazole with pristine and B-, Al-, Ga-doped C60 fullerenes

I. Muz, M. Kurban, Mustafa Kurban, 2021 .

Stochastic search, fragmentation, electronic and reactivity properties of neutral and cationic hydrogenated Li6 clusters

I. Muz, O. Canko, Murat Atis, 2014 .

Ab initio study of structural and electronic properties of SinC5-nH8 (n = 0–5) series: Probing the 2D to 3D structural transition

I. Muz, M. Kurban, 2018 .

Zinc oxide nanoclusters and their potential application as CH4 and CO2 gas sensors: Insight from DFT and TD‐DFT

I. Muz, M. Kurban, Mustafa Kurban, 2022, J. Comput. Chem..

Ab initio search for global minimum structures of neutral and anionic hydrogenated Li5 clusters

I. Muz, O. Canko, E. Yildirim, 2013 .

Enhanced Adsorption of Fluoroquinolone Antibiotic on the Surface of the Mg-, Ca-, Fe- and Zn-doped C60 Fullerenes: DFT and TD-DFT Approach

I. Muz, Iskender Muz, 2022, Materials Today Communications.

A comprehensive study on electronic structure and optical properties of carbon nanotubes with doped B, Al, Ga, Si, Ge, N, P and As and different diameters

I. Muz, M. Kurban, 2019, Journal of Alloys and Compounds.

Size dependence in the electronic and optical properties of a BN analogue of two-dimensional graphdiyne: A theoretical study

I. Muz, M. Kurban, Fahrettin Göktaş, 2020 .

Size-dependent adsorption performance of ZnO nanoclusters for drug delivery applications

I. Muz, M. Kurban, 2022, Structural Chemistry.

A density functional theory study on favipiravir drug interaction with BN-doped C60 heterofullerene

I. Muz, M. Kurban, Fahrettin Göktaş, 2022, Physica E: Low-dimensional Systems and Nanostructures.

Theoretical investigation of the adsorption behaviors of fluorouracil as an anticancer drug on pristine and B-, Al-, Ga-doped C36 nanotube

I. Muz, M. Kurban, Mustafa Kurban, 2020 .

A DFT study on stability and electronic structure of AlN nanotubes

I. Muz, M. Kurban, Hasan Kurban, 2021 .

DFT and TD-DFT studies of new pentacene-based organic molecules as a donor material for bulk-heterojunction solar cells

Mehmet M. Dalkilic, I. Muz, M. Kurban, 2020, Journal of Computational Electronics.

Enhancement of electronic, photophysical and optical properties of 5,5′-Dibromo-2,2′-bithiophene molecule: new aspect to molecular design

I. Muz, M. Kurban, 2019, Opto-Electronics Review.

Structure, Ionization, and Fragmentation of Hydrogenated Aluminoboron Clusters: Al2B2H2n (n=0‐6)

I. Muz, O. Canko, M. Atis, 2016 .

Structural transformations in the carborane series: CnB6−nH6 (n = 0–6) upon substitution of boron by carbon

I. Muz, M. Atis, 2016 .

Boron-doped hydrogenated Al-3 clusters: A material for hydrogen storage

I. Muz, M. Atis, 2016 .

Structural transition of C6−nSinNH7 at n = 0–6 clusters upon substitution of carbon by silicon

I. Muz, 2019, Inorganica Chimica Acta.

The electronic structure, transport and structural properties of nitrogen-decorated graphdiyne nanomaterials

I. Muz, M. Kurban, Mustafa Kurban, 2020 .

Electronic structures and bonding of graphdiyne and its BN analogs: Transition from quasi-planar to planar sheets

I. Muz, M. Kurban, Mustafa Kurban, 2020 .

Sensing capability and diameter-dependent electronic structure of boron nitride nanotubes

I. Muz, M. Kurban, S. Alaei, 2021 .

Search for the global minimum structures of AlB3H2n (n = 0 − 6) clusters

Iskender Muz, Osman Canko, Murat Atis, 2015, J. Comput. Chem..

Analysis of the geometrical properties and electronic structure of arsenide doped boron clusters: Ab-initio approach

I. Muz, M. Kurban, Kazım Şanli, 2018 .

The Investigation of Structural and Electronic Properties of Charged and Uncharged Arsenide Doped Boron Clusters using Density Functional Theory

I. Muz, H. Bektaş, Yüklü ve Yüksüz, 2017 .

Electronic Transport and Non-linear Optical Properties of Hexathiopentacene (HTP) Nanorings: A DFT Study

I. Muz, M. Kurban, Mustafa Kurban, 2020, Journal of Electronic Materials.