Faculty Publications
Permanent URI for this communityhttps://idr.nitk.ac.in/handle/123456789/18736
Publications by NITK Faculty
Browse
3 results
Search Results
Item Investigation of hole-injection in ?-NPD using capacitance and impedance spectroscopy techniques with F4TCNQ as hole-injection layer: Initial studies(Academic Press, 2014) Fernandes, J.M.; Raveendra Kiran, M.R.; Ulla, H.; Satyanarayan, M.N.; Umesh, G.The charge accumulation leading to injection at the organic interface in the sequentially doped hole-only device structure is studied using capacitance and impedance based spectroscopic techniques. In this paper, we investigate the role of p-type dopant 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (F4TCNQ) in the charge transport properties of N,N'-Di(1-naphthyl)-N,N'-diphenyl-(1,1?-biphenyl)-4,4?-diamine (?-NPD) through sequential deposition. We show that the hole injection into ?-NPD increases with the increase of interlayer (F4TCNQ) thickness by correlating the current density-voltage, capacitance-voltage, capacitance-frequency and impedance measurements. © 2014 Elsevier Ltd. All rights reserved.Item Photophysical and electrochemical properties of organic molecules: Solvatochromic effect and DFT studies(Elsevier B.V., 2018) Mohan, M.; Pangannaya, S.; Satyanarayan, M.N.; Trivedi, D.R.A series of five Schiff base molecules M1, M2, M3, M4 and M5 have been designed and synthesized by aldol condensation reaction. Synthesized molecules have been characterized by standard spectroscopic techniques in order to confirm their structural traits. The solvatochromic behavior of molecules M1 to M5 in solvents of varying polarity were investigated by UV–Vis, fluorescence spectroscopy and supported by TD-DFT calculations. DFT studies performed in the gas phase confirmed the energy stabilized structure of the molecules M1 to M5. Structural characteristics of molecule M2 favored higher fluorescence emission with a quantum yield of 0.35 and a solid-state emission of 512 nm. Fluorescence lifetime measurement of the molecules M1 to M5 exhibited a lifetime of order 2–5 ns. Overall, molecule M2 can find its application in organic light emitting diodes as a non-dopant emitter material. © 2018 Elsevier B.V.Item Functionalized pyrene-based AIEgens: synthesis, photophysical characterization and density functional theory studies(John Wiley and Sons Ltd, 2019) Mohan, M.; James, J.; Satyanarayan, M.N.; Trivedi, D.Three new pyrene-based derivatives P1, P2 and P3 with a substituted pyrazole were designed, synthesized and characterized using standard spectroscopic techniques. Ultraviolet–visible (UV–vis) spectroscopic studies for P1–P3 uncovered a finite bathochromic shift of the molecules in solvents of varying polarity. Photoluminescence (PL) studies revealed the significant fluorescence emission of all molecules in higher polar solvents such as MeOH and dimethylformamide (DMF). Fluorescence quantum yield studies demonstrated the importance of P3 possessing cyanofunctionality for imparting higher emission with a quantum yield of 0.36%. Ratiometric studies performed in a tetrahydrofuran (THF)/H2O mixture indicated fluorescence enhancement with increasing overall percentage of water, confirming the aggregation-induced emission effect. Cyclic voltammetry study of molecules P1–P3 revealed an irreversible oxidation peak and the band gaps were calculated to be 2.26 eV for P1 and 2.31 eV for P2 and P3 respectively. Density functional theory (DFT) studies performed on molecules P1–P3 validate the structure correlation of the molecules. Theoretically estimated highest occupied molecular orbital (HOMO), lowest unoccupied molecular orbital (LUMO) and bandgap correlated well with the experimental values. Furthermore, time-dependent (TD)DFT showed that the major contribution for the electronic transitions occurring in the system was governed by HOMO-1 and LUMO+1 orbitals. © 2019 John Wiley & Sons, Ltd.