<p>Semi-analytical models for remote sensing of water quality parameters need to be parameterized with specific inherent optical properties. In this thesis, data on specific inherent optical properties of Swedish lakes and coastal waters is presented. Also, the problems of measuring in situ spectral backscattering are addressed. It is shown how measured specific inherent optical properties are used to parameterize semi-analytical bio-optical models. The models are then used to produce large synthetic data sets based on the distribution of water quality parameters, and from these data sets, band ratio or single band ratio algorithms for remote estimation of water quality parameters are constructed. A similar model was also used to calculate under water PAR from measured water quality parameters.</p><p>The specific inherent optical properties of Swedish lakes and coastal waters are very similar to earlier reported data from the oceanic environment. However, different relations of the water quality parameters will affect the inherent optical properties absorption and backscattering. The absorption spectra are dominated by yellow substance with terrestrial origin. Phytoplankton absorption is low, and account in general only for about 10 % of the total absorption in regions where phytoplankton pigments are active. The spectral backscattering is dominated by suspended particulate inorganic matter. Phytoplankton backscattering is almost negligible, except in cases where the phytoplankton community is dominated by highly scattering cyanobacteria. Experiences from remote sensing campaigns and modeling shows that remote chlorophyll estimation is most effective at longer wavelengths, where the absorption of yellow substance is low. However, modeling also predicts that large uncertainties have to be expected in the estimation of chlorophyll, both from variation in the specific phytoplankton absorption and from influences of other optically active water quality parameters.</p>

The Indian Ocean Experiment (INDOEX) had as a primary objective determining the radiative forcing due to anthropogenic aerosols over climatologically significant space and time scales: the Indian Ocean during the winter monsoon, January-March. During the winter monsoon, polluted, low-level air from the Asian subcontinent blows over the Arabian Sea and Indian Ocean. As part of INDOEX, aerosol optical depths were derived from Advanced Very High Resolution Radiometer (AVHRR) data for the cloud-free ocean regions. The AVHRR radiances were first calibrated using the interior zone of the Antarctic and Greenland ice sheets, which proved to be radiometrically stable calibration targets. Optical depths were derived by matching the observed radiances to radiances calculated for a wide range of optical depths and viewing geometry. Optical depths derived with the AVHRR were compared with those derived with NASA's Aerosol Robotic Network (AERONET) CIMEL instrument at the Center for Clouds, Chemistry, and Climate's Kaashidhoo Observatory, as well as with other surface and shipboard observations taken in the INDOEX region. The retrieved and surface-based optical depths agreed best for a new 2-channel, 2- aerosol model scheme in which the AVHRR observations at O·64 and O·84 microns were used to determine relative amounts of marine and polluted continental aerosol and then the resulting aerosol mixture was used to derive the optical depths. Broadband radiative transfer calculations for the mixture of marine and polluted continental aerosols were combined with the 0·64 and 0·84-micron AVHRR radiances to determine the radiative forcing due to aerosols in the INDOEX region. Monthly composites of aerosol optical depth and top of the atmosphere, surface, and atmospheric radiative forcing were derived from calibrated AVHRR radiances for January-March 1996-2000. An inter-annual variability in the magnitude and spatial extent of high value regions is noted for derived optical depths and radiative forcing, with highest values reached in 1999, particularly in the Bay of Bengal which during the IFP was covered by plumes from Indochina. Frequency distributions of the optical depth for 1⁰ x 1⁰ latitude-longitude regions are well represented by gamma distribution functions. The day-to-day and year-to-year variability of the optical depth for such regions is correlated with the long term average optical depth. Interannual variability of the monthly mean optical depths for such regions is found to be as large as the day to day. / Graduation date: 2001

In an effort to develop an optical-acoustical understanding of ultrasound contrast agent microbubble dynamics in a micro-environment that resembles blood vessels, this thesis presents experimental work on optical trapping and acoustical probing of ultrasound contrast agent microbubbles confined in regenerated cellulose capillaries. First, we showed by acoustical means that the pressure threshold of an individual microbubble shell rupture increases significantly when confined in regenerated cellulose capillaries. We report that the shell rupture threshold in regenerated cellulose capillaries increased by at least 0.3 MPa from 0.8 MPa for unconfined microbubbles. Second, we achieved optical trapping and manipulation of ultrasound contrast agent microbubbles confined in capillaries using Hermite-Gaussian laser beams. / Graduation date: 2012

In this dissertation, I present electronic spectroscopy of a few biologically relevant species and their complexes with solvent molecules in the gas phase using a variety of techniques, including resonantly enhanced multiphoton ionization (REMPI), laser induced fluorescence (LIF), and zero kinetic energy (ZEKE) photoelectron spectroscopy. My work on several methylated uracils and thymines and thymine-water complexes alludes to a new interpretation with regard to the origin of the photostability of our genetic code. I believe that it is the water solvent that stabilizes the photophysical and photochemical behavior of these bases under UV irradiation. For systems that demonstrate vibrational resolution in the first electronically excited state (S₁) and the cationic state, I performed vibrational analysis of both states with the aid of ab initio and density functional calculations. These observations are explained in terms of the structural changes from the ground state to S₁ and further to the cation. To bridge results from the gas phase to the solution phase, I also report studies of supersonically cooled water complexes of the three isomers of aminobenzoic acid. Density functional theory calculations are carried out to identify structural minima of water complexes in the ground state. The solvation mechanism is investigated based on vibrational analysis of the S₁ state of the neutral complex and the shift of ionization thresholds with increasing water content. / Graduation date: 2005

Graduation date: 1995

Graduation date: 1994

Nanotechnology is the science and technology of manipulating materials at atomic and molecular scale with properties different from bulk. Semiconductor QDs are important class of nanomaterials with unique physical and chemical properties owing to the quantum confinement effect. Size dependent optical properties make research on semiconductor QDs more attractive in the field of nanotechnology. Semiconductor QDs are usually composed of combination of elements from groups II–VI, III–V, or IV–VI of the periodic table. Group II-VI semiconductor QDs (ZnS, ZnSe, ZnO, CdSe, CdS) are most extensively studied systems, having bandgap which can be engineered through the variation of the material composition and size. Most common QDs are made of CdE (E=S, Se, Te) which are toxic. Recent environmental regulations restrict the use of toxic metals and therefore QDs containing nontoxic metals such as Zn are of great importance. The chemical synthesis of QDs involves different methods. Usually high temperature thermal decomposition of organometallic compounds in high boiling point organic solvents is used which needs long reaction time and involves complex synthesis procedures. New simpler and efficient synthetic routes with alternative solvents are required. Recently the synthesis of non-toxic QDs using green chemical routes is a promising approach receiving increasing attention. The aim of this Thesis is to develop novel routes for synthesis of semiconductor QDs employing green nanomaterial synthesis techniques. Therefore, in this work, we developed different green chemical routes mainly for the synthesis Zn-based QDs. Low temperature synthesis routes were developed for the synthesis of ZnS and ZnO QDs. Microwave irradiation was also used as efficient heating source which creates numerous nucleation sites in the solution, leading to the formation of homogeneous nanoparticles with small size and narrow size distribution. Different polar solvents with high MW absorption were used for synthesis of ZnS QDs. We also introduced ionic liquids as solvents in the synthesis of ZnS QDs using microwave heating. ILs are excellent reaction media for absorbing microwaves and are recognized as ‘green’ alternative to volatile and toxic organic solvents. For ZnS systems, the QDs produced by different methods were less than 5 nm in size as characterized by high-resolution transmission electron microscopy (HR-TEM). Selected area electron diffraction (SAED) patterns revealed that ZnS QDs synthesized by low temperature synthesis technique using conventional heating are of cubic crystalline phase while the QDs synthesized by using MW heating are of wurtzite phase. The optical properties were investigated by UV-Vis absorption spectrum and show a blue shift in absorption as compared to bulk due to quantum confinement effect. The photoluminescence (PL) spectra of ZnS QDs show different defect states related emission peaks and depend on different synthesis methods, high bandedge related emission is observed for ZnS QDs synthesized by using ionic liquids. ZnO QDs synthesized by low temperature route were found to be less than 4 nm in size and also show a blue shift in their absorption. The PL spectrum show bandedge related emission which is blue shifted compared with bulk with no emission originating from surface defect levels. The results show that QDs are of high crystalline quality with narrow size distribution. A comparative study of using conventional and MW heating in the synthesis of CdSe QDs was performed. The reactions involving microwave heating showed enhanced rates and higher yields. The developed methods involve all principles for green nanomaterials synthesis i.e. design of safer nanomaterials, reduced environmental impact, waste reduction, process safety, materials and energy efficiency. / <p>QC 20121115</p>

Semi-analytical models for remote sensing of water quality parameters need to be parameterized with specific inherent optical properties. In this thesis, data on specific inherent optical properties of Swedish lakes and coastal waters is presented. Also, the problems of measuring in situ spectral backscattering are addressed. It is shown how measured specific inherent optical properties are used to parameterize semi-analytical bio-optical models. The models are then used to produce large synthetic data sets based on the distribution of water quality parameters, and from these data sets, band ratio or single band ratio algorithms for remote estimation of water quality parameters are constructed. A similar model was also used to calculate under water PAR from measured water quality parameters. The specific inherent optical properties of Swedish lakes and coastal waters are very similar to earlier reported data from the oceanic environment. However, different relations of the water quality parameters will affect the inherent optical properties absorption and backscattering. The absorption spectra are dominated by yellow substance with terrestrial origin. Phytoplankton absorption is low, and account in general only for about 10 % of the total absorption in regions where phytoplankton pigments are active. The spectral backscattering is dominated by suspended particulate inorganic matter. Phytoplankton backscattering is almost negligible, except in cases where the phytoplankton community is dominated by highly scattering cyanobacteria. Experiences from remote sensing campaigns and modeling shows that remote chlorophyll estimation is most effective at longer wavelengths, where the absorption of yellow substance is low. However, modeling also predicts that large uncertainties have to be expected in the estimation of chlorophyll, both from variation in the specific phytoplankton absorption and from influences of other optically active water quality parameters.

Atmospheric particles are ubiquitous in the Earth’s atmosphere and have potential to influence atmospheric chemistry, visibility, global climate and human health, particularly downwind from major pollution sources. The main objective of this thesis was to investigate questions pertaining to the microphysical, chemical and optical properties of aerosol particles by using in situ data collected during four experiments carried out in different regions of the Northern Hemisphere. The first two papers of this thesis reports on airborne measurements of the aerosol optical properties performed over the North Atlantic and the Los Angeles basin. Airmasses from Europe and North Africa are usually advected in over the North Atlantic, alternating with the background marine conditions. The results showed that the aerosols are not uniformly distributed in the area and variability in the aerosol fields occurs at sub-synoptic scales. It was also observed that the single scattering coefficient varied as the polluted plumes aged, suggesting a relationship between this quantity and transport time. The measurements performed around the Los Angeles basin showed that the area’s complex topography and local meteorological circulations exert a strong control on the distribution of the aerosol in the basin. Large spatio-temporal gradients in the aerosol optical properties were observed along a transect flown from the shore towards the mountains. Profiles flown over sites located on the mountains displayed a stratified configuration with elevated aerosol layers. Airborne data of residual particles collected in orographic wave clouds over Scandinavia were analyzed using a single particle analysis technique. Mineral dust, organic aerosols and sea salt were the main group of particles identified. Residuals composed predominantly of mineral dust were found in glaciated clouds while organic residuals were found in liquid clouds. The results suggest that organic material may inhibit freezing and have considerable influence on supercooled clouds that form through heterogeneous pathways. The partitioning of the aerosol particles between cloud droplets and interstitial air has been addressed in terms of their microphysical properties using data obtained at a mountain-top site in Sweden during a stratocumulus event. The results showed that the scavenging efficiency varied during the cloud event, and Aitken-mode particles were also efficiently scavenged in addition to accumulation-mode particles. It is hypothesized that alterations of the aerosol chemical composition occurred during the measurement period, modifying the hygroscopic nature of the particles and decreasing their activation diameter.

The electronic structure and optical properties of metallic nanoparticles are theoretically investigated front first principles. An efficient implementation of time-dependent density functional theory allows a fully quantum mechanical description of systems large enough to display collective electron oscillations and surface plasmon modes. The results are compared with traditional classical electrodynamical approaches. Different regimes of interest are identified, both where classical electrodynamical models yield accurate descriptions, and where quantum effects are indispensable for understanding plasmonic properties in nanostructures. The limits of validity of classical electrodynamics are clearly established for the study of a variety of relevant geometries.