Spectral Properties of α and β L Rhamno-Indigo Molecules and Activities Prediction Through NBO Analysis. A DFT Study

2016 ◽  
Vol 230 (5-7) ◽  
Author(s):  
Khadidja Adjir ◽  
Majda Sekkal-Rahal ◽  
Aurélien Moncomble ◽  
Jean-Paul Cornard
Keyword(s):  
Physical Properties ◽  
Spectral Properties ◽  
Nbo Analysis ◽  
Dft Study ◽  
Spectral Features

AbstractStructural and physical properties such as some spectral features of

Physical properties of ultrasonically spray deposited Yttrium-doped SnO2 nanostructured films: supported by DFT study

2021 ◽  
Vol 127 (4) ◽  
Author(s):  
Esra Kaya ◽  
Ali Uğur ◽  
Arife Gencer Imer ◽  
Murat Aycibin ◽  
Yusuf Selim Ocak
Keyword(s):  
Physical Properties ◽  
Dft Study ◽  
Nanostructured Films

scholarly journals Vibrational, electronic, spectroscopic properties, and NBO analysis of p-xylene, 3,6-difluoro-p-xylene, 3,6-dichloro-p-xylene and 3,6-dibromo-pxylene: DFT study

Heliyon ◽  
2020 ◽  
Vol 6 (12) ◽  
pp. e05783
Author(s):  
Emmanuel A. Bisong ◽  
Hitler Louis ◽  
Tomsmith O. Unimuke ◽  
Joseph O. Odey ◽  
Emmanuel I. Ubana ◽  
...  
Keyword(s):  
Spectroscopic Properties ◽  
Nbo Analysis ◽  
Dft Study

Intramolecular hydrogen bonds in the sulfonamide derivatives of oxamide, dithiooxamide, and biuret. FT-IR and DFT study, AIM and NBO analysis

Tetrahedron ◽  
2010 ◽  
Vol 66 (44) ◽  
pp. 8551-8556 ◽  
Author(s):  
B.A. Shainyan ◽  
N.N. Chipanina ◽  
T.N. Aksamentova ◽  
L.P. Oznobikhina ◽  
G.N. Rosentsveig ◽  
...  
Keyword(s):  
Hydrogen Bonds ◽  
Nbo Analysis ◽  
Dft Study ◽  
Intramolecular Hydrogen Bonds ◽  
Ft Ir ◽  
Intramolecular Hydrogen ◽  
Derivatives Of ◽  
Aim And Nbo

scholarly journals Close-range remote sensing of Saturn’s rings during Cassini’s ring-grazing orbits and Grand Finale

Science ◽  
2019 ◽  
Vol 364 (6445) ◽  
pp. eaau1017 ◽  
Author(s):  
Matthew S. Tiscareno ◽  
Philip D. Nicholson ◽  
Jeffrey N. Cuzzi ◽  
Linda J. Spilker ◽  
Carl D. Murray ◽  
...  
Keyword(s):  
Remote Sensing ◽  
Physical Properties ◽  
Optical Depth ◽  
Spectral Properties ◽  
Dynamical Processes ◽  
Ring Structures ◽  
Close Range ◽  
Saturn’S Rings ◽  
F Ring ◽  
Saturn's Rings

Saturn’s rings are an accessible exemplar of an astrophysical disk, tracing the Saturn system’s dynamical processes and history. We present close-range remote-sensing observations of the main rings from the Cassini spacecraft. We find detailed sculpting of the rings by embedded masses, and banded texture belts throughout the rings. Saturn-orbiting streams of material impact the F ring. There are fine-scaled correlations among optical depth, spectral properties, and temperature in the B ring, but anticorrelations within strong density waves in the A ring. There is no spectral distinction between plateaux and the rest of the C ring, whereas the region outward of the Keeler gap is spectrally distinct from nearby regions. These results likely indicate that radial stratification of particle physical properties, rather than compositional differences, is responsible for producing these ring structures.

A NUMERICAL MODEL OF THE SPECTRAL PROPERTIES OF SHORT PULSE DISTRIBUTED ER3+-DOPED FIBER AMPLIFIER

1995 ◽  
Vol 04 (02) ◽  
pp. 511-526
Author(s):  
V. STOEV ◽  
T. MIRTCHEV
Keyword(s):  
Numerical Model ◽  
Pulse Duration ◽  
Spectral Properties ◽  
Dopant Concentration ◽  
Short Pulse ◽  
Input Pulse ◽  
Fiber Amplifier ◽  
Numerical Results ◽  
Spectral Features ◽  
Spectral Performance

We model the spectral performance of a short pulse, distributed Er 3+-doped fiber amplifier. Extensive numerical results illustrating how these spectral features depend on the input pulse duration, pumping configuration and dopant concentration are presented.

DFT study with different exchange-correlation potentials of physical properties of the new synthesized alkali-metal based Heusler alloy

2020 ◽  
Vol 93 (11) ◽  
Author(s):  
Tariq Hadji ◽  
Hafid Khalfoun ◽  
Habib Rached ◽  
Youcef Guermit ◽  
Ahmed Azzouz-Rached ◽  
...  
Keyword(s):  
Alkali Metal ◽  
Physical Properties ◽  
Heusler Alloy ◽  
Dft Study ◽  
Exchange Correlation
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