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Browsing by Author "Gandhi, Viraj D."
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Item Enhancing Separation and Constriction of Ion Mobility Distributions in Drift Tubes at Atmospheric Pressure Using Varying Fields(American Chemical Society, 2022-03-31) Chen, Xi; Latif, Mohsen; Gandhi, Viraj D.; Chen, Xuemeng; Hua, Leyan; Fukushima, Nobuhiko; Larriba-Andaluz, Carlos; Mechanical and Energy Engineering, School of Engineering and TechnologyA linearly decreasing electric field has been previously proven to be effective for diffusional correction of ions in a varying field drift tube (VFDT) system, leading to higher resolving powers compared to a conventional drift tube due to its capacity to narrow distributions midflight. However, the theoretical predictions in resolving power of the VFDT were much higher than what was observed experimentally. The reason behind this discrepancy has been identified as the difference between the theoretically calculated resolving power (spatial) and the experimental one (time). To match the high spatial resolving power experimentally, a secondary high voltage pulse (HVP) at a properly adjusted time is used to provide the ions with enough momentum to increase their drift velocity and hence their time-resolving power. A series of systematic numerical simulations and experimental tests have been designed to corroborate our theoretical findings. The HVP-VFDT atmospheric pressure portable system improves the resolving power from the maximum expected of 60–80 for a regular drift tube to 250 in just 21 cm in length and 7kV, an unprecedent accomplishment.Item Field-Switching Repeller Flowing Atmospheric-Pressure Afterglow Drift Tube Ion Mobility Spectrometry(American Chemical Society, 2022-03-02) Latif, Mohsen; Chen, Xi; Gandhi, Viraj D.; Larriba-Andaluz, Carlos; Gamez, Gerardo; Mechanical and Energy Engineering, School of Engineering and TechnologyIn this work, a field-switching (FS) technique is employed with a flowing atmospheric pressure afterglow (FAPA) source in drift tube ion mobility spectrometry (DTIMS). The premise is to incorporate a tip-repeller electrode as a substitute for the Bradbury–Nielsen gate (BNG) so as to overcome corresponding disadvantages of the BNG, including the gate depletion effect (GDE). The DTIMS spectra were optimized in terms of peak shape and full width by inserting an aperture at the DTIMS inlet that was used to control the neutral molecules’ penetration into the separation region, thus preventing neutral-ion reactions inside. The FAPA and repeller’s experimental operating conditions including drift and plasma gas flow rates, pulse injection times, repeller positioning and voltage, FAPA current, and effluent angle were optimized. Ion mobility spectra of selected compounds were captured, and the corresponding reduced mobility values were calculated and compared with the literature. The 6-fold improvements in limit of detection (LOD) compared with previous work were obtained for 2,6-DTBP and acetaminophen. The enhanced performance of the FS-FAPA-DTIMS was also investigated as a function of the GDE when compared with FAPA-DTIMS containing BNG.Item Measurement and Theory of Gas-Phase Ion Mobility Shifts Resulting from Isotopomer Mass Distribution Changes(American Chemical Society, 2021) Harrilal, Christopher P.; Gandhi, Viraj D.; Nagy, Gabe; Chen, Xi; Buchanan, Michael G.; Wojcik, Roza; Conant, Christopher R.; Donor, Micah T.; Ibrahim, Yehia M.; Garimella, Sandilya V.B.; Smith, Richard D.; Larriba-Andaluz, Carlos; Mechanical and Energy Engineering, School of Engineering and TechnologyThe unanticipated discovery of recent ultra-high-resolution ion mobility spectrometry (IMS) measurements revealing that isotopomers─compounds that differ only in the isotopic substitution sites─can be separated has raised questions as to the physical basis for their separation. A study comparing IMS separations for two isotopomer sets in conjunction with theory and simulations accounting for ion rotational effects provides the first-ever prediction of rotation-mediated shifts. The simulations produce observable mobility shifts due to differences in gas-ion collision frequency and translational-to-rotational energy transfer. These differences can be attributed to distinct changes in the moment of inertia and center of mass between isotopomers. The simulations are in broad agreement with the observed experiments and consistent with relative mobility differences between isotopomers. These results provide a basis for refining IMS theory and a new foundation to obtain additional structural insights through IMS.Item Parametric Designs and Weight Optimization using Direct and Indirect Aero-structure Load Transfer Methods(2019-08) Gandhi, Viraj D.; Dalir, Hamid; Dannenhoffer, John F., III; Larriba-Andaluz, CarlosWithin the aerospace design, analysis and optimization community, there is an increasing demand to finalize the preliminary design phase of the wing as quickly as possible without losing much on accuracy. This includes rapid generation of designs, an early adaption of higher fidelity models and automation in structural analysis of the internal structure of the wing. To perform the structural analysis, the aerodynamic load can be transferred to the wing using many different methods. Generally, for preliminary analysis, indirect load transfer method is used and for detailed analysis, direct load transfer method is used. For the indirect load transfer method, load is discretized using shear-moment-torque (SMT) curve and applied to ribs of the wing. For the direct load transfer method, the load is distributed using one-way Fluid-Structure Interaction (FSI) and applied to the skin of the wing. In this research, structural analysis is performed using both methods and the nodal displacement is compared. Further, to optimize the internal structure, iterative changes are made in the number of structural members. To accommodate these changes in geometry as quickly as possible, the parametric design method is used through Engineering SketchPad (ESP). ESP can also provide attributions the geometric feature and generate multi-fidelity models consistently. ESP can generate the Nastran mesh file (.bdf) with the nodes and the elements grouped according to their geometric attributes. In this research, utilizing the attributions and consistency in multi-fidelity models an API is created between ESP and Nastran to automatize the multi-fidelity structural optimization. This API generates the design with appropriate parameters and mesh file using ESP. Through the attribution in the mesh file, the API works as a pre-processor to apply material properties, boundary condition, and optimization parameters. The API sends the mesh file to Nastran and reads the results file to iterate the number of the structural member in design. The result file is also used to transfer the nodal deformation from lower-order fidelity structural models onto the higher-order ones to have multi-fidelity optimization. Here, static structural optimization on the whole wing serves as lower fidelity model and buckling optimization on each stiffened panel serves as higher fidelity model. To further extend this idea, a parametric model of the whole aircraft is also created.Item Predicting ion mobility as a function of the electric field for small ions in light gases(Elsevier, 2021-11) Gandhi, Viraj D.; Larriba-Andaluz, Carlos; Mechanical and Energy Engineering, School of Engineering and TechnologyHigh resolution mobility devices such as Field Asymmetric Waveform Ion Mobility Spectrometry (FAIMS) and Differential Mobility spectrometers (DMS) use strong electric fields to gas concentration ratios, E/N, to separate ions in the gas phase. While extremely successful, their empirical results show a non-linear, ion-dependent relation between mobility K and E/N that is difficult to characterize. The one-temperature theory Mason-Schamp equation, which is the most widely used ion mobility equation, unfortunately, cannot capture this behavior. When the two-temperature theory is used, it can be shown that the K−E/N behavior can be followed quite closely numerically by equating the effect of increasing the field to an increase in the ion temperature. This is attempted here for small ions in a Helium gas environment showing good agreement over the whole field range. To improve the numerical characterization, the Lennard-Jones (L-J) potentials may be optimized. This is attempted for Carbon, Hydrogen, Oxygen and Nitrogen at different degrees of theory up to the fourth approximation, which is assumed to be exact. The optimization of L-J improves the accuracy yielding errors of about 3% on average. The fact that a constant set of L-J potentials work for the whole range of E/N and for several molecules, also suggests that inelastic collisions can be circumvented in calculations for He. The peculiar K−E/N hump behaviors are studied, and whether mobility increases or decreases with E/N is shown to derive from a competition between relative kinetic energy and the interaction potentials.