Electronic structure and optical properties of the Ag 3 SbS 3 crystal: experimental and DFT studies

MY Rudysh, GL Myronchuk, AO Fedorchuk… - Physical Chemistry …, 2023 - pubs.rsc.org
A high-quality Ag3SbS3 single crystal was grown by the Bridgman–Stockbarger method and
its crystalline structure and homogeneity were investigated. The fundamental absorption …

Structure, optical, and electronic properties of sodium ammonium sulfate dehydrate crystal

MY Rudysh, PA Shchepanskyi, OY Khyzhun… - Optical Materials, 2025 - Elsevier
This paper presents the results of theoretical and experimental investigation of the electronic
structure and optical properties of the sodium ammonium sulfate dihydrate (SASD) crystal. A …

Growth, crystal structure and theoretical studies of energy and optical properties of CdTe1−xSex thin films

AI Kashuba, HA Ilchuk, RY Petrus, B Andriyevsky… - Applied …, 2022 - Springer
CdTe 1-x Se x (CTS, x≈ 0.1) thin film was prepared by quasi close-space sublimation
method. The phase analysis and crystal structure refinement was examined with using X-ray …

Electronic structure and elastic properties of CdSeTe solid state solution: first principles study

AI Kashuba, B Andriyevsky, HA Ilchuk… - arXiv preprint arXiv …, 2021 - arxiv.org
The electronic band structure and elastic properties of the Cd ${} _ {16} $ Se ${} _ {15} $ Te
solid state solution in the framework of the density functional theory calculations are …

[PDF][PDF] Electronic band structure of cubic solid-state CdTe1–xSex solutions

HA Ilchuk, B Andriyevsky, OS Kushnir… - Ukr. J. Phys …, 2021 - researchgate.net
We report on the electronic band structure of solid-state solutions CdTe1–xSex (CTS, 0< x≤
5/16) calculated in the framework of density functional theory. The structure of CTS is …

Structural, Electronic and Optical Properties of CsPbBr3 and CH3NH3PbBr3: First-Principles Modeling

M Kovalenko, O Bovgyra, V Kolomiets… - 2021 IEEE 12th …, 2021 - ieeexplore.ieee.org
Organic-inorganic hybrid perovskites have recently attracted attention as important materials
for their potential ability as solar cells, light-emitting devices, and photonic applications. In …

[PDF][PDF] Elastic properties of CdTexSe1–x (x= 1/16) solid solution: first principles study

HA Ilchuk, DV Korbutyak, AI Kashuba… - … ., Quant. Electron. & …, 2020 - journal-spqeo.org.ua
Elastic properties of the CdTe1–xSex (x= 1/16) solid solution in the framework of the density
functional theory calculations have been investigated. The structure of the sample has been …

First Principles Calculation of Band Structure and Physical Properties of Ferroelectric (NH4)2BeF4 Crystal

M Rudysh, B Horon, P Shchepanskyi… - 2021 IEEE 12th …, 2021 - ieeexplore.ieee.org
Ab initio calculations of the ferroelectric phase ammonium fluoroberyllate crystal (NH4) 2
BeF 4 (AFB)(space group Pcn 2 1) in the framework of density functional theory (DFT) were …

СТРУКТУРА ТА ЕЛЕКТРОННІ ВЛАСТИВОСТІ ПЕРОВСКІТУ CsPbBr3: ПЕРШОПРИНЦИПНІ РОЗРАХУНКИ.

М Коваленко, О Бовгира… - Journal of Physical …, 2021 - search.ebscohost.com
Неорганічний перовскіт бромід цезію свинцю (CsPbBr3)-широко досліджуваний
матеріал завдÿки свой потенційній можливості застосуваннÿ в сонÿчних елементах та …

Phase transition in impurity crystals of potassium sulfate: refractive parameters

V Stadnyk, P Shchepanskyi, M Rudysh… - 2021 IEEE 12th …, 2021 - ieeexplore.ieee.org
The temperature changes of birefringence and refractive indices of the impurity crystal of
potassium sulfate were studied. It is found that the curves Δn_i(T) and ni (T) do not change …