Linear and Nonlinear Optical Susceptibilities of Ag3PS4 and Ag5PS4Cl2 Compounds.

Result code in IS VaVaI

<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F49777513%3A23640%2F14%3A43921997" target="_blank" >RIV/49777513:23640/14:43921997 - isvavai.cz</a>

Result on the web

—

DOI - Digital Object Identifier

—

Result language

angličtina

Original language name

Linear and Nonlinear Optical Susceptibilities of Ag3PS4 and Ag5PS4Cl2 Compounds.

Original language description

The complex density functional theory (DFT) calculations of linear and nonlinear optical susceptibilities for the Ag3PS4 and Ag5PS4Cl2 compounds have been reported, using the full potential linearized augmented plane wave (FP-LAPW) method. We have employed the local density approximation (LDA), generalized gradient approximation (GGA-PBE). In additional the Engel- Vosko generalized gradient approximation (EVGGA) formalism, which optimizes the corresponding potential for the spectral features of the linear and nonlinear optical susceptibilities, was employed. We have calculated the frequency-dependent complex epsilon(omega), its zero-frequency limit epsilon1(omega), refractive index n(omega), the reflectivity R(omega) and electron energy loss function L(omega). Calculations are also reported for the frequency-dependent complex second-order nonlinear optical susceptibilities. We find opposite signs of the contributions of the 2(omega) and 1(omega) inter/intra-band to the imaginary part f

Czech name

—

Czech description

—

Type

J_x - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

CEP classification

BE - Theoretical physics

OECD FORD branch

—

Project

<a href="/en/project/ED2.1.00%2F03.0088" target="_blank" >ED2.1.00/03.0088: Centre of the New Technologies and Materials</a><br>

Continuities

P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)

Publication year

2014

Confidentiality

S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Name of the periodical

International Journal of Engineering Research & Technology

ISSN

2278-0181

e-ISSN

—

Volume of the periodical

3

Issue of the periodical within the volume

2

Country of publishing house

IN - INDIA

Number of pages

7

Pages from-to

564-570

UT code for WoS article

—

EID of the result in the Scopus database

—