Matching Items (3)
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- All Subjects: Photovoltaic Cells
- Creators: Ponce, Fernando
Description
The absorption spectra of metal-centered phthalocyanines (MPc's) have been investigated since the early 1960's. With improved experimental techniques to characterize this class of molecules the band assignments have advanced. The characterization remains difficult with historic disagreements. A new push for characterization came with a wave of interest in using these molecules for absorption/donor molecules in organic photovoltaics. The use of zinc phthalocyanine (ZnPc) became of particular interest, in addition to novel research being done for azaporphyrin analogs of ZnPc.
A theoretical approach is taken to research the excited states of these molecules using time-dependent density functional theory (TDDFT). Most theoretical results for the first excited state in ZnPc are in only limited agreement with experiment (errors near 0.1 eV or higher). This research investigates ZnPc and 10 additional porphyrin analogs. Excited-state properties are predicted for 8 of these molecules using ab initio computational methods and symmetry breaking for accurate time- dependent self-consistent optimization. Franck-Condon analysis is used to predict the Q-band absorption spectra for all 8 of these molecules. This is the first time that Franck-Condon analysis has been reported in absolute units for any of these molecules. The first excited-state energy for ZnPc is found to be the closest to experiment thus far using a range-separated meta-GGA hybrid functional. The theoretical results are used to find a trend in the novel design of new porphyrin analog molecules.
A theoretical approach is taken to research the excited states of these molecules using time-dependent density functional theory (TDDFT). Most theoretical results for the first excited state in ZnPc are in only limited agreement with experiment (errors near 0.1 eV or higher). This research investigates ZnPc and 10 additional porphyrin analogs. Excited-state properties are predicted for 8 of these molecules using ab initio computational methods and symmetry breaking for accurate time- dependent self-consistent optimization. Franck-Condon analysis is used to predict the Q-band absorption spectra for all 8 of these molecules. This is the first time that Franck-Condon analysis has been reported in absolute units for any of these molecules. The first excited-state energy for ZnPc is found to be the closest to experiment thus far using a range-separated meta-GGA hybrid functional. The theoretical results are used to find a trend in the novel design of new porphyrin analog molecules.
ContributorsTheisen, Rebekah (Author) / Adams, James B (Thesis advisor) / Li, Jian (Committee member) / Ponce, Fernando (Committee member) / Arizona State University (Publisher)
Created2014
Description
In recent years, there has been increased interest in the Indium Gallium Nitride (InGaN) material system for photovoltaic (PV) applications. The InGaN alloy system has demonstrated high performance for high frequency power devices, as well as for optical light emitters. This material system is also promising for photovoltaic applications due to broad range of bandgaps of InxGa1-xN alloys from 0.65 eV (InN) to 3.42 eV (GaN), which covers most of the electromagnetic spectrum from ultraviolet to infrared wavelengths. InGaN’s high absorption coefficient, radiation resistance and thermal stability (operating with temperature > 450 ℃) makes it a suitable PV candidate for hybrid concentrating solar thermal systems as well as other high temperature applications. This work proposed a high efficiency InGaN-based 2J tandem cell for high temperature (450 ℃) and concentration (200 X) hybrid concentrated solar thermal (CSP) application via numerical simulation. In order to address the polarization and band-offset issues for GaN/InGaN hetero-solar cells, band-engineering techniques are adopted and a simple interlayer is proposed at the hetero-interface rather than an Indium composition grading layer which is not practical in fabrication. The base absorber thickness and doping has been optimized for 1J cell performance and current matching has been achieved for 2J tandem cell design. The simulations also suggest that the issue of crystalline quality (i.e. short SRH lifetime) of the nitride material system to date is a crucial factor limiting the performance of the designed 2J cell at high temperature. Three pathways to achieve ~25% efficiency have been proposed under 450 ℃ and 200 X. An anti-reflection coating (ARC) for the InGaN solar cell optical management has been designed. Finally, effective mobility model for quantum well solar cells has been developed for efficient quasi-bulk simulation.
ContributorsFang, Yi, Ph.D (Author) / Vasileska, Dragica (Thesis advisor) / Goodnick, Stephen (Thesis advisor) / Ponce, Fernando (Committee member) / Nemanich, Robert (Committee member) / Arizona State University (Publisher)
Created2017
Description
The primary goal of this thesis work is to determine the activation energy for encapsulant browning reaction of photovoltaic (PV) modules using outdoor field degradation data and indoor accelerated degradation data. For the outdoor field data, six PV modules fielded in Arizona (hot climate) over 21 years and four PV modules fielded in New York (cold climate) over 18 years have been analyzed. All the ten modules were manufactured by the same manufacturer with glass/EVA/cell/EVA/back sheet construction. The activation energy for the encapsulant browning is calculated using the degradation rates of short-circuit current (Isc, the response parameter), weather data (temperature, humidity, and UV, the stress parameters) and different empirical rate models such as Arrhenius, Peck, Klinger and modified Peck models. For the indoor accelerated data, three sets of mini-modules with the same construction/manufacturer as that of the outdoor fielded modules were subjected indoor accelerated weathering stress and the test data were analyzed. The indoor accelerated test was carried out in a weathering chamber at the chamber temperature of 20°C, chamber relative humidity of 65%, and irradiance of 1 W/m2 at 340nm using a xenon arc lamp. Typically, to obtain activation energy, the test samples are stressed at two (or more) temperatures in two (or more) chambers. However, in this work, it has been attempted to do the acceleration testing of eight mini-modules at multiple temperatures using a single chamber. Multiple temperatures in a single chamber were obtained using thermal insulators on the back of the mini-modules. Depending on the thickness of the thermal insulators with constant solar gain from the xenon lamp, different temperatures on the test samples were achieved using a single weathering chamber. The Isc loss and temperature of the mini-modules were continuously monitored using a data logger. Also, the mini-modules were taken out every two weeks and various characterization tests such as IV, QE, UV fluorescence and reflectance were carried out. Activation energy from the indoor accelerated tests was calculated using the short circuit current degradation rate and operating temperatures of the mini-modules. The activation energy for the encapsulant browning obtained from the outdoor field data and the indoor accelerated data are compared and analyzed in this work.
ContributorsVeerendra Kumar, Deepak Jain (Author) / Tamizhmani, Govindasamy (Committee member) / Srinivasan, Devarajan (Committee member) / Rogers, Bradley (Committee member) / Arizona State University (Publisher)
Created2016