Browsing by Subject "Sulfur compounds"

Now showing 1 - 6 of 6

Open Access
Colloidal nanoplatelet/conducting polymer hybrids: excitonic and material properties
(American Chemical Society, 2016) Guzelturk, B.; Menk, F.; Philipps, K.; Kelestemur Y.; Olutas M.; Zentel, R.; Demir, Hilmi Volkan
Here we present the first account of conductive polymer/colloidal nanoplatelet hybrids. For this, we developed DEH-PPV-based polymers with two different anchor groups (sulfide and amine) acting as surfactants for CdSe nanoplatelets, which are atomically flat semiconductor nanocrystals. Hybridization of the polymers with the nanoplatelets in the solution phase was observed to cause strong photoluminescence quenching in both materials. Through steady-state photoluminescence and excitation spectrum measurements, photoluminescence quenching was shown to result from dominant exciton dissociation through charge transfer at the polymer/nanoplatelet interfaces that possess a staggered (i.e., type II) band alignment. Importantly, we found out that sulfide-based anchors enable a stronger emission quenching than amine-based ones, suggesting that the sulfide anchors exhibit more efficient binding to the nanoplatelet surfaces. Also, shorter surfactants were found to be more effective for exciton dissociation as compared to the longer ones. In addition, we show that nanoplatelets are homogeneously distributed in the hybrid films owing to the functional polymers. These nanocomposites can be used as building blocks for hybrid optoelectronic devices, such as solar cells.
Open Access
Density functional theory investigation of substituent effects on building blocks of conducting polymers
(Elsevier, 1999) Salzner, U.
Substituted heterocyclic dimers were calculated employing density functional theory (DFT) and analyzed with the natural bond orbits method (NBO). Substitution in 3- and 4-positions leads to parallel shifting of HOMO and LUMO but does not reduce energy gaps. For bridge dimers, HOMO-LUMO gaps correlate with π-electron densities in the carbon backbone and energy gap reduction correlate with the strength of π-π* interactions from the backbone to the bridging group. Alternating donor-acceptor groups do not reduce energy gaps and lead to systems with average HOMO and LUMO levels compared to the parent molecules.
Open Access
Electrochemical and XPS studies of corrosion behaviour of a low carbon steel in the presence of FT2000 inhibitor
(Elsevier Science Publishers B.V., 2001) Kadirgan, F.; Süzer, Şefik
Corrosion behaviour of a new inhibitor (FT2000) is investigated in saline solution on a low carbon steel in the neutral aqueous media at 60 °C. Effect of sulphate ion is also studied. Corrosion rate, polarization resistance, and efficiency of the inhibitor are calculated. The nature of the protecting layer formed in the presence of the inhibitor is investigated by X-ray photoelectron spectroscopy, XPS.
Open Access
Investigation of charge carriers in doped thiophene oligomers through theoretical modeling of their UV/Vis spectra
(2008) Salzner, U.
The nature of the charge carriers in conducting organic polymers (COPs) is a long standing problem. Polythiophene is one of the prototypes of COPs and intensively studied. Because doping leads to changes in UV/vis spectra that are characteristic of the absorbing species, UV/vis spectra of charged thiophene oligomers with up to 25 rings were calculated with time-dependent density functional theory. The credibility of the method was established by comparing the results with a variety of theoretical levels and with experiment. Effects due to counterions (Cl3-) and solvent (CH 2Cl2) were examined. It was found that TDDFT employing hybrid functionals is accurate enough to distinguish the absorbing species. The findings offer an explanation for the experimentally observed difference in UV-spectra of medium-sized and long oligomers upon doping. As chain lengths of the oligomers increase and energy levels get closer, configuration interaction leads to additional absorption peaks in the high energy sub-band region (at around 1.5-2.5 eV). Thus, long oligomers do not behave differently from medium-sized ones upon doping, only their spectra are different. At low doping levels radical cations (polarons) are produced. At higher doping levels, dications that harbor weakly interacting polaron pairs are formed. Bipolarons are predicted only on very short chains or at high doping levels. There is no bipolaron binding energy and disproportionation of monocations into dications and neutral species is energetically unfavorable. © 2008 American Chemical Society.
Open Access
Skin-like self-assembled monolayers on InAs / GaSb superlattice photodetectors
(IOP Institute of Physics Publishing, 2012) Salihoglu, O.; Muti, A.; Kutluer, K.; Tansel, T.; Turan, R.; Aydınlı, Atilla
We report on the effects of monolayer (ML) thick skin-like octadecanethiol (ODT, CH 3[CH 2] 17SH) on type-II InAs/GaSb MWIR photodetectors. Circumventing the ageing effects of conventional sulfur compounds, we use ODT, a self-assembling, long molecular chain headed with a sulfur atom. Photodiodes coated with and without the self-assembled monolayer (SAM) ODT were compared for their electrical and optical performances. For ODT-coated diodes, the dark current density was improved by two orders of magnitude at 77K under 100mV bias. The zero bias responsivity and detectivity were 1.04AW 1 and 2.15 × 10 13 Jones, respectively, at 4μm and 77K. The quantum efficiency was determined to be 37% for a cutoff wavelength of 5.1μm.
Open Access
Theoretical and spectroscopic investigations on the structure and bonding in B-C-N thin films
(2009) Bengu, E.; Genisel, M. F.; Gulseren, O.; Ovali, R.
In this study, we have synthesized boron, carbon, and nitrogen containing films using RF sputter deposition. We investigated the effects of deposition parameters on the chemical environment of boron, carbon, and nitrogen atoms inside the films. Techniques used for this purpose were grazing incidence reflectance-Fourier-transform infrared spectroscopy (GIR-FTIR), X-ray photoelectron spectroscopy (XPS), transmission electron microscopy (TEM) and electron energy loss spectroscopy (EELS). GIR-FTIR experiments on the B-C-N films deposited indicated presence of multiple features in the 600 to 1700 cm- 1 range for the infrared (IR) spectra. Analysis of the IR spectra, XPS and the corresponding EELS data from the films has been done in a collective manner. The results from this study suggested even under nitrogen rich synthesis conditions carbon atoms in the B-C-N films prefer to be surrounded by other carbon atoms rather than boron and/or nitrogen. Furthermore, we have observed a similar behavior in the chemistry of B-C-N films deposited with increasing substrate bias conditions. In order to better understand these results, we have compared and evaluated the relative stability of various nearest-neighbor and structural configurations of carbon atoms in a single BN sheet using DFT calculations. These calculations also indicated that structures and configurations that increase the relative amount of C-C bonding with respect to B-C and/or C-N were energetically favorable than otherwise. As a conclusion, carbon tends to phase-segregate in to carbon clusters rather than displaying a homogeneous distribution for the films deposited in this study under the deposition conditions studied.