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The recent experimental synthesis of 2D graphitic C3N5 has attracted lot of interests in its electronic and optical properties and its comparison with other graphitic C3N4 and C3N3. To this end, we performed DFT calculations using more…

Materials Science · Physics 2022-07-19 Shakti Singh , P. Anees , Sharat Chandra , Tapan Ghanty

The surface states of the active TiO2 layer is crucial while fabricating an efficient solar cell. This work experimentally analyses the effect of exposing TiO2 based electron transport layer (ETL) to the ultraviolet-ozone (UV-O3) and…

Applied Physics · Physics 2020-02-28 Chandan Dawo , Mohammad Adil Afroz , Parameswar Krishnan Iyer , Harsh Chaturvedi

First principles calculations of the electronic structure of trigonal iron were performed using density function theory. The results are used to predict lattice spacings, magnetic moments and elastic properties; these are in good agreement…

mtrl-th · Physics 2009-10-28 S. Fox , H. J. F. Jansen

Ferromagnetic semiconductors discovered in two-dimensional (2D) materials open an avenue for highly integrated and multifunctional spintronics. The Curie temperature (TC) of existed 2D ferromagnetic semiconductors is extremely low and the…

Materials Science · Physics 2021-11-02 Wenxuan Zhu , Cheng Song , Lei Han , Hua Bai , Qian Wang , Siqi Yin , Lin Huang , Tongjin Chen , Feng Pan

The surface ligands on colloidal nanocrystals (NCs) play an important role in the performance of NCs based optoelectronic devices such as photovoltaic cells, photodetectors and light emitting diodes (LEDs). On one hand, the NC emission…

Chemical Physics · Physics 2020-04-27 Prachi Rastogi , Francisco Palazon , Mirko Prato , Francesco Di Stasio , Roman Krahne

The layered transition metal chalcogenides have been a fertile land in solid state physics for many decades. Various MX2-type transition metal dichalcogenides, such as WTe2, IrTe2, and MoS2, have triggered great attention recently, either…

Currently, Sb$_2$Se$_3$ thin films receive considerable research interest as a solar cell absorber material. When completed into a device stack, the major bottleneck for further device improvement is the open circuit voltage, which is the…

The electromagnetic modes and their field distributions are evaluated for a dielectric cylindrical structure embedded in another dielectric, with a thin metallic film at the cylinder/dielectric interface. These modes provide energy…

Atomic Physics · Physics 2009-11-07 G. D. Banyard , C. R. Bennett , M. Babiker

Physical vapor high-temperature deposition of CdTe thin films is one of the main methods for preparing high-efficiency CdTe solar cells, but high-temperature deposition also has an impact on the internal structure of the film. The…

Materials Science · Physics 2023-08-09 Wenxiong Zhao , Yufeng Zhang

Transition metal dichalcogenide (TMD) materials have emerged as promising candidates for thin film solar cells due to their wide bandgap range across the visible wavelengths, high absorption coefficient and ease of integration with both…

Applied Physics · Physics 2020-07-01 Elaine McVay , Ahmad Zubair , Yuxuan Lin , Amirhasan Nourbakhsh , Tomás Palacios

We report here investigations on the instability in luminescence of bare (TOPO-stabilized) and CdS- capped CdSe particles under infrared radiation. During photo-thermal annealing the formation of oxide layers on the surfaces of the…

Materials Science · Physics 2009-11-11 A. Singha , A. Roy

g-C3N4 is a novel semiconductor photocatalyst material; however, the low specific surface area and rapid carrier compliance hinder its photocatalytic performance. On the other hand, the synthesis of 2D g-C3N4 with high crystallinity remains…

Applied Physics · Physics 2023-06-21 Ying Du , Meng Wu , Hui-Qiong Wang , Junyong Kang

We studied the electronic structure of high quality Cr(110) films grown on W(110) surface employing photoemission spectroscopy. Experiments on the differently aged samples revealed distinct signatures of the surface and bulk features in the…

Materials Science · Physics 2015-06-25 Khadiza Ali , Shyama R. Varier , Deepnarayan Biswas , Srinivas C. Kandukuri , Kalobaran Maiti

Geometrical confinement effect in exfoliated sheets of layered materials leads to significant evolution of energy dispersion with decreasing layer thickness. Molybdenum disulphide (MoS2) was recently found to exhibit indirect to direct gap…

Materials Science · Physics 2014-03-13 Weijie Zhao , Zohreh Ghorannevis , Leiqiang Chua , Minglin Toh , Christian Kloc , Ping-Heng Tan , Goki Eda

The wurtzite (wz) structure of CdS is analyzed using density functional theory within the generalized gradient approximation (GGA) and Hubbard correction (GGA+U). The total energy convergence evaluation is carried out concerning energy…

Materials Science · Physics 2022-06-22 Ankan Biswas , S. R. Meher , Deepak K. Kaushik

The electronic Seebeck response in a conductor involves the energy-dependent mean free path of the charge carriers and is affected by crystal structure, scattering from boundaries and defects, and strain. Previous photothermoelectric (PTE)…

Calculations of the optical properties of GeTe in the cubic NaCl and rhombohedral ferroelectric structures are reported. The rhombohedral ferroelectric distortion increases the band gap from 0.11 eV to 0.38 eV. Remarkably, substantial…

Materials Science · Physics 2013-05-24 David J. Singh

Polycrystalline hcp metals - an important class of engineering materials - typically exhibit complex plasticity because of a limited number of slip systems. Among these metals, deformation is even more complicated in cobalt as it commonly…

Doping cadmium oxide with rare earth (RE) elements is a way to control the band gap and enhance carrier concentration and mobility. This work presents how one of REs, europium, impacts performance of CdO/Si diode. The samples were grown…

We report the detailed optical properties of Cd$_3$As$_2$ crystals in a wide parameter space: temperature, magnetic field, carrier concentration and crystal orientation. We investigate high-quality crystals synthesized by three different…