Spectroscopic and TD-DFT studies on the turn-off fluorescent chemosensor based on anthraldehyde N(4) cyclohexyl thiosemicarbazone for the selective recognition of fluoride and copper ions

Polyhedron ◽  
2016 ◽  
Vol 109 ◽  
pp. 7-18 ◽  
Author(s):  
Sabeel M. Basheer ◽  
Anthony C. Willis ◽  
Ron J. Pace ◽  
Anandaram Sreekanth
Keyword(s):  
Copper Ions ◽  
Fluorescent Chemosensor ◽  
Selective Recognition ◽  
Dft Studies ◽  
Td Dft

Condensation pigments for pigment printing of cotton - synthesis, photophysical properties, TD-DFT studies

2015 ◽  
Vol 16 (4) ◽  
pp. 809-818 ◽  
Author(s):  
Amol S. Choudhary ◽  
Sharad Patil ◽  
Nagaiyan Sekar
Keyword(s):  
Photophysical Properties ◽  
Dft Studies ◽  
Td Dft

DFT and TD-DFT studies of phenothiazine based derivatives as fluorescent materials for semiconductor applications

2021 ◽  
Vol 134 ◽  
pp. 106036
Author(s):  
Shamsa Bibi ◽  
Faiza Farooq ◽  
Shafiq-ur-Rehman ◽  
Fu Quan Bai ◽  
Hong-Xing Zhang
Keyword(s):  
Dft Studies ◽  
Td Dft ◽  
Fluorescent Materials

Spectroscopic (FTIR, FT-Raman, 1H NMR and UV–Vis) and DFT/TD-DFT studies on cholesteno [4,6-b,c]-2′,5′-dihydro-1′,5′-benzothiazepine

2019 ◽  
Vol 1178 ◽  
pp. 570-582 ◽  
Author(s):  
Mohammad Jane Alam ◽  
Azhar U. Khan ◽  
Mahboob Alam ◽  
Shabbir Ahmad
Keyword(s):  
1H Nmr ◽  
Dft Studies ◽  
Td Dft ◽  
Ft Raman

scholarly journals A multifunctional selective “turn-on” fluorescent chemosensor for detection of Group IIIA ions Al3+, Ga3+ and In3+

2018 ◽  
Vol 17 (9) ◽  
pp. 1247-1255 ◽  
Author(s):  
Hyo Jung Jang ◽  
Ji Hye Kang ◽  
Dongju Yun ◽  
Cheal Kim
Keyword(s):  
Metal Ions ◽  
Fluorescent Chemosensor ◽  
Selective Recognition ◽  
Turn On

A versatile chemosensor was developed for highly distinguishable and selective recognition of group IIIA metal ions (Al3+, Ga3+ and In3+).

Spectrophotometric and photocatalytic studies of H-bonded charge transfer complex of oxalic acid with imidazole: single crystal XRD, experimental and DFT/TD-DFT studies

2019 ◽  
Vol 43 (23) ◽  
pp. 9039-9051 ◽  
Author(s):  
Ishaat M. Khan ◽  
Kehkashan Alam ◽  
Mohammad Jane Alam ◽  
Musheer Ahmad
Keyword(s):  
Hydrogen Bonding ◽  
Photocatalytic Activity ◽  
Charge Transfer ◽  
Oxalic Acid ◽  
Single Crystal ◽  
Charge Transfer Complex ◽  
Single Crystal Xrd ◽  
Dft Studies ◽  
Td Dft ◽  
Ct Complex

The photocatalytic activity of a new CT complex was tested. Spectrophotometric studies were performed to understand its formation through N+–H⋯O− hydrogen bonding, and the structure was confirmed by single crystal XRD.

scholarly journals Correction: A smart molecular probe for selective recognition of nitric oxide in 100% aqueous solution with cell imaging application and DFT studies

2019 ◽  
Vol 17 (10) ◽  
pp. 2825-2825 ◽  
Author(s):  
Ananya Dutta ◽  
Abu Saleh Musha Islam ◽  
Debjani Maiti ◽  
Mihir Sasmal ◽  
Chandraday Prodhan ◽  
...  
Keyword(s):  
Nitric Oxide ◽  
Aqueous Solution ◽  
Cell Imaging ◽  
Molecular Probe ◽  
Selective Recognition ◽  
Dft Studies ◽  
Imaging Application

Correction for ‘A smart molecular probe for selective recognition of nitric oxide in 100% aqueous solution with cell imaging application and DFT studies’ by Ananya Dutta et al., Org. Biomol. Chem., 2019, DOI: 10.1039/c9ob00177h.

DFT and TD-DFT studies on symmetrical squaraine dyes for nanocrystalline solar cells

2010 ◽  
Vol 141 (5) ◽  
pp. 549-555 ◽  
Author(s):  
Jie Xu ◽  
Hui Zhang ◽  
Lei Wang ◽  
Guijie Liang ◽  
Luoxin Wang ◽  
...  
Keyword(s):  
Solar Cells ◽  
Dft Studies ◽  
Squaraine Dyes ◽  
Td Dft
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