Subwavelength imaging and detection using adjustable and movable droplet microlenses
We developed adjustable and movable droplet microlenses consisting of a liquid with a high
refractive index. The microlenses were prepared via ultrasonic shaking in deionized water …
refractive index. The microlenses were prepared via ultrasonic shaking in deionized water …
Spectroscopic analysis of cinnamic acid using quantum chemical calculations
KS Vinod, S Periandy, M Govindarajan - Spectrochimica Acta Part A …, 2015 - Elsevier
In this present study, FT-IR, FT-Raman, 13 C NMR and 1 H NMR spectra for cinnamic acid
have been recorded for the vibrational and spectroscopic analysis. The observed …
have been recorded for the vibrational and spectroscopic analysis. The observed …
FT-IR, FT-Raman, dispersive Raman, NMR spectroscopic studies and NBO analysis of 2-Bromo-1H-Benzimidazol by density functional method
EB Sas, M Kurt, M Karabacak, A Poiyamozhi… - Journal of Molecular …, 2015 - Elsevier
In this study, geometrical optimization, FT-IR (4000–400 cm− 1), FT-Raman (4000–40 cm−
1), dispersive Raman (4000–40 cm− 1) spectroscopic analysis, electronic structure and 1 H …
1), dispersive Raman (4000–40 cm− 1) spectroscopic analysis, electronic structure and 1 H …
Structure, spectroscopic study and DFT calculations of 2, 6 bis (tri fluro methyl) benzoic acid
KR Santhy, MD Sweetlin, S Muthu, TK Kuruvilla… - Journal of Molecular …, 2019 - Elsevier
The work involves the vibrational spectral analysis of 2.6 bis (tri fluro methyl) benzoic acid
using FT-IR and FT-Raman spectroscopy. The computations were performed at DFT level of …
using FT-IR and FT-Raman spectroscopy. The computations were performed at DFT level of …
Spectroscopic properties, NLO, HOMO–LUMO and NBO of maltol
V Krishnakumar, D Barathi, R Mathammal… - … Acta Part A: Molecular …, 2014 - Elsevier
Abstract Maltol (3-hydroxy-2-methyl-4pyrone) is widely known as metal ions chelator with
many practical applications in catalysis, medicine and food chemistry. The FTIR and FT …
many practical applications in catalysis, medicine and food chemistry. The FTIR and FT …
[PDF][PDF] The adsorption mechanism, structural and electronic properties of pyrrole adsorbed ZnO nano clusters in the field photovoltaic cells by density functional theory
D Sethupandian, KB Banu - Indian Journal of Pure & Applied …, 2019 - op.niscpr.res.in
An exhaustive quantum chemical analysis of structural and electronic properties have been
investigated for pure and pyrrole adsorption on semiconductor nano-clusters Zn3O3 (P …
investigated for pure and pyrrole adsorption on semiconductor nano-clusters Zn3O3 (P …
Molecular structure, vibrational spectroscopy, NBO and HOMO, LUMO studies of o-methoxybenzonitrile
M Elanthiraiyan, B Jayasudha… - Spectrochimica Acta Part A …, 2015 - Elsevier
In the present study, the FT-IR and FT-Raman spectra of o-methoxybenzonitrile (O-MBN)
have been recorded in the region 4000–400 cm− 1 and 3500–50 cm− 1, respectively. The …
have been recorded in the region 4000–400 cm− 1 and 3500–50 cm− 1, respectively. The …
Conformational analysis, UV–VIS, MESP, NLO and NMR studies of 6-methoxy-1, 2, 3, 4-tetrahydronaphthalene
M Arivazhagan, R Kavitha, VP Subhasini - Spectrochimica Acta Part A …, 2014 - Elsevier
The detailed HF and B3LYP/6-311++ G (d, p) comparative studies on the complete FT-IR
and FT-Raman spectra of 6-methoxy-1, 2, 3, 4-tetrahydronaphthalene [MTHN] have been …
and FT-Raman spectra of 6-methoxy-1, 2, 3, 4-tetrahydronaphthalene [MTHN] have been …
DFT analysis on the molecular structure, vibrational and electronic spectra of 2-(cyclohexylamino) ethanesulfonic acid
TSR Devi, GR Ramkumaar - Spectrochimica Acta Part A: Molecular and …, 2015 - Elsevier
Abstract The FTIR and FT-Raman spectra of 2-(cyclohexylamino) ethanesulfonic acid were
recorded in the regions 4000–400 cm− 1 and 4000–50 cm− 1 respectively. The structural …
recorded in the regions 4000–400 cm− 1 and 4000–50 cm− 1 respectively. The structural …
FT-IR, FT-Raman spectra, density functional computations of the vibrational spectra, molecular geometry, conformational stability and some molecular properties of 1 …
G Mariappan, N Sundaraganesan - Journal of Molecular Structure, 2014 - Elsevier
In this work of theoretical structural analysis, a comprehensive screening of the recent DFT
theoretical approach to structural analysis is presented for the molecule 1-Bromo-2, 3 …
theoretical approach to structural analysis is presented for the molecule 1-Bromo-2, 3 …