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Epitaxial Electrodeposition Of Ordered Inorganic Materials, Jay A. Switzer, Avishek Banik Jan 2023

Epitaxial Electrodeposition Of Ordered Inorganic Materials, Jay A. Switzer, Avishek Banik

Chemistry Faculty Research & Creative Works

Conspectus The quality of technological materials generally improves as the crystallographic order is increased. This is particularly true in semiconductor materials, as evidenced by the huge impact that bulk single crystals of silicon have had on electronics. Another approach to producing highly ordered materials is the epitaxial growth of crystals on a single-crystal surface that determines their orientation. Epitaxy can be used to produce films and nanostructures of materials with a level of perfection that approaches that of single crystals. It may be used to produce materials that cannot be grown as large single crystals due to either economic or …

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Nucleotide Detection Mechanism And Comparison Based On Low-Dimensional Materials: A Review, M. Mustafa Azeem, Muhammad Shafa, Muhammad Aamir, Muhammad Zubair, Basma Souayeh, Mir Waqas Alam Jan 2023

Nucleotide Detection Mechanism And Comparison Based On Low-Dimensional Materials: A Review, M. Mustafa Azeem, Muhammad Shafa, Muhammad Aamir, Muhammad Zubair, Basma Souayeh, Mir Waqas Alam

Civil, Architectural and Environmental Engineering Faculty Research & Creative Works

The recent pandemic has led to the fabrication of new nucleic acid sensors that can detect infinitesimal limits immediately and effectively. Therefore, various techniques have been demonstrated using low-dimensional materials that exhibit ultrahigh detection and accuracy. Numerous detection approaches have been reported, and new methods for impulse sensing are being explored. All ongoing research converges at one unique point, that is, an impetus: the enhanced limit of detection of sensors. There are several reviews on the detection of viruses and other proteins related to disease control point of care; however, to the best of our knowledge, none summarizes the various …

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Nuclear Magnetic Resonance Study Of Co2 Capture By Fluoroalkylamines: Ammonium Ion Pka Depression Via Fluorine Modification And Thermochemistry Of Carbamylation, Brian Jameson, Kari Knobbe, Rainer Glaser Jan 2023

Nuclear Magnetic Resonance Study Of Co2 Capture By Fluoroalkylamines: Ammonium Ion Pka Depression Via Fluorine Modification And Thermochemistry Of Carbamylation, Brian Jameson, Kari Knobbe, Rainer Glaser

Chemistry Faculty Research & Creative Works

We are developing energy-efficient and reversible carbon capture and release (CCR) systems that mimic the Lys201 carbamylation reaction in the active site of ribulose-1,5-bisphosphate carboxylase-oxygenase (RuBisCO). The multiequilibria scenario ammonium ion Xa ⇌ amine Xb ⇌ carbamic acid Xc ⇌ carbamate Xd requires the presence of both free amine and CO2 for carbamylation and is affected by the pKa(Xa). Two fluorination strategies aimed at ammonium ion pKa depression and low pH carbamylation were analyzed with (2,2,2-trifluoroethyl) butylamine 2b and 2,2-difluoropropylamine 3b and compared to butylamine 1b. The determination of K1 and ΔG1 of the carbamylation reactions requires the solution of …

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Natural Product Co-Metabolism And The Microbiota–Gut–Brain Axis In Age-Related Diseases, Mark Obrenovich, Sandeep Kumar Singh, Yi Li, George Perry, Bushra Siddiqui, Waqas Haq, V. Prakash Reddy Jan 2023

Natural Product Co-Metabolism And The Microbiota–Gut–Brain Axis In Age-Related Diseases, Mark Obrenovich, Sandeep Kumar Singh, Yi Li, George Perry, Bushra Siddiqui, Waqas Haq, V. Prakash Reddy

Chemistry Faculty Research & Creative Works

Complementary alternative medicine approaches are growing treatments of diseases to standard medicine practice. Many of these concepts are being adopted into standard practice and orthomolecular medicine. Age-related diseases, in particular neurodegenerative disorders, are particularly difficult to treat and a cure is likely a distant expectation for many of them. Shifting attention from pharmaceuticals to phytoceuticals and "bugs as drugs" represents a paradigm shift and novel approaches to intervention and management of age-related diseases and downstream effects of aging. Although they have their own unique pathologies, a growing body of evidence suggests Alzheimer's disease (AD) and vascular dementia (VaD) share common …

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Extracellular Poly(Hydroxybutyrate) Bioplastic Production Using Surface Display Techniques, Kevin Beaver, Ashwini Dantanarayana, Willisa Liou, Markus Babst, Shelley D. Minteer Jan 2023

Extracellular Poly(Hydroxybutyrate) Bioplastic Production Using Surface Display Techniques, Kevin Beaver, Ashwini Dantanarayana, Willisa Liou, Markus Babst, Shelley D. Minteer

Chemistry Faculty Research & Creative Works

Poly(hydroxybutyrate) is a biocompatible, biodegradable polyester synthesized naturally in a variety of microbial species. A greener alternative to petroleum-based plastics and sought after for biomedical applications, poly(hydroxybutyrate) has failed to break through as a leading material in the plastic industry due to its high cost of production. Specifically, the extraction of this material from within bacterial cells requires lysis of cells, which takes time, uses harsh chemicals, and starts the process again with growing new living cells. Recently, surface display of enzymes on bacterial membranes has become an emerging technique for extracellular biocatalysis. In this work, a fusion protein lpp-ompA-phaC …

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Effect Of Eggshell Powder And Nano-Hydroxyapatite On The Surface Roughness And Microhardness Of Bleached Enamel, Shahinaz Hassan, Lamiaa Moharam Jan 2023

Effect Of Eggshell Powder And Nano-Hydroxyapatite On The Surface Roughness And Microhardness Of Bleached Enamel, Shahinaz Hassan, Lamiaa Moharam

Chemical and Biochemical Engineering Faculty Research & Creative Works

Background: The aim of the study was to evaluate the remineralizing potential of prepared solutions of eggshell powder (ESP) and nano-hydroxyapatite (nHA) on the surface roughness and microhardness of bleached enamel. Materials and Methods: Fifty bovine anterior teeth were selected and cleaned then bleached using a chemically activated in-office bleaching agent then the teeth were randomly allocated into five groups (n = 10) according to the tested remineralizing agents (10% ESP solution, 10% nHA solution, and MI Paste Plus) into; control, bleached, bleached + ESP solution, bleached + nHA solution, and bleached + MI Paste Plus groups. Then, the teeth …

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Extending The Nno Ballistic Limit Equation To Foam-Filled Dual-Wall Systems, William P. Schonberg Jan 2023

Extending The Nno Ballistic Limit Equation To Foam-Filled Dual-Wall Systems, William P. Schonberg

Civil, Architectural and Environmental Engineering Faculty Research & Creative Works

A key component in the quantitative assessment of the risk posed to spacecraft by the micrometeoroid and orbital debris (MMOD) environment is frequently referred to as a ballistic limit equation (BLE). A frequently used BLE for dual-wall configurations (which are commonly used on spacecraft to protect them against the MMOD environment) is the New Non-Optimum, or "NNO", BLE. In design applications where a BLE is needed for a new structural system that has not yet been tested, but resembles to a fair degree a dual-wall system, it is common practice to equivalence the materials, thicknesses, etc., of the new system …

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Evaluation Of Thermal And Rheological Properties Of Phase Change Material-Incorporated Asphalt Mastic With Porous Fillers, Farshad Saberi Kerahroudi, Yizhuang David Wang, Jenny Liu Jan 2023

Evaluation Of Thermal And Rheological Properties Of Phase Change Material-Incorporated Asphalt Mastic With Porous Fillers, Farshad Saberi Kerahroudi, Yizhuang David Wang, Jenny Liu

Civil, Architectural and Environmental Engineering Faculty Research & Creative Works

Incorporating phase change material (PCM) into paving materials can regulate the pavement temperature, improve the pavement durability, and mitigate the heat-island effects. In this research, porous fillers were used as the PCM carrier, and the thermal and rheological behaviors of the asphalt mastic with the PCM were evaluated. Two different carrier materials (diatomite and expanded perlite) and four types of PCMs were used in the study. The candidate filler, PCM, and proper blending ratios were determined based on the results of scanning electron microscope image analysis, the filter paper test, and the temperature sweep test. The thermal and rheological behaviors …

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Stability And Dynamics Across Magnetic Phases Of Vortex-Bright Type Excitations In Spinor Bose-Einstein Condensates, Garyfallia C. Katsimiga, Simeon I. Mistakidis, K. Mukherjee, P. G. Kevrekidis, P. Schmelcher Jan 2023

Stability And Dynamics Across Magnetic Phases Of Vortex-Bright Type Excitations In Spinor Bose-Einstein Condensates, Garyfallia C. Katsimiga, Simeon I. Mistakidis, K. Mukherjee, P. G. Kevrekidis, P. Schmelcher

Physics Faculty Research & Creative Works

The Static Properties, I.e., Existence And Stability, As Well As The Quench-Induced Dynamics Of Vortex-Bright Type Excitations In Two-Dimensional Harmonically Confined Spin-1 Bose-Einstein Condensates Are Investigated. Linearly Stable Vortex-Bright-Vortex And Bright-Vortex-Bright Solutions Arise In Both Antiferromagnetic And Ferromagnetic Spinor Gases Upon Quadratic Zeeman Energy Shift Variations. Their Deformations Across The Relevant Transitions Are Exposed And Discussed In Detail, Evincing Also That Emergent Instabilities Can Lead To Pattern Formation. Spatial Elongations, Precessional Motion, And Spiraling Of The Nonlinear Excitations When Exposed To Finite Temperatures And Upon Crossing The Distinct Phase Boundaries, Via Quenching Of The Quadratic Zeeman Coefficient, Are Unveiled. Spin-Mixing …

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Additively Manufactured Carbon Fiber- Reinforced Thermoplastic Composite Mold Plates For Injection Molding Process, C. Bivens, A. Wood, D. Ruble, M. Rangapuram, S. K. Dasari, K. Chandrashekhara, J. Degrange Jan 2023

Additively Manufactured Carbon Fiber- Reinforced Thermoplastic Composite Mold Plates For Injection Molding Process, C. Bivens, A. Wood, D. Ruble, M. Rangapuram, S. K. Dasari, K. Chandrashekhara, J. Degrange

Mechanical and Aerospace Engineering Faculty Research & Creative Works

Polymer injection molding processes have been used to create high-volume parts quickly and efficiently. Injection molding uses mold plates that are traditionally made of very hard tool steels, such as P20 steel, which is extremely heavy and has very long lead times to build new molds. In this study, composite-based additive manufacturing (CBAM) was used to create mold plates using long-fiber carbon fiber and polyether ether ketone (PEEK). These mold plates were installed in an injection molding machine, and rectangular flat plates were produced using Lustran 348 acrylonitrile butadiene styrene (ABS). Tensile and flexural testing was performed on these parts …

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Fine-Grained Activity Classification In Assembly Based On Multi-Visual Modalities, Haodong Chen, Niloofar Zendehdel, Ming-Chuan Leu, Zhaozheng Yin Jan 2023

Fine-Grained Activity Classification In Assembly Based On Multi-Visual Modalities, Haodong Chen, Niloofar Zendehdel, Ming-Chuan Leu, Zhaozheng Yin

Mechanical and Aerospace Engineering Faculty Research & Creative Works

Assembly activity recognition and prediction help to improve productivity, quality control, and safety measures in smart factories. This study aims to sense, recognize, and predict a worker's continuous fine-grained assembly activities in a manufacturing platform. We propose a two-stage network for workers' fine-grained activity classification by leveraging scene-level and temporal-level activity features. The first stage is a feature awareness block that extracts scene-level features from multi-visual modalities, including red, green blue (RGB) and hand skeleton frames. We use the transfer learning method in the first stage and compare three different pre-trained feature extraction models. Then, we transmit the feature information …

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Comparison Of The Thermal Stability In Equal-Channel-Angular-Pressed And High-Pressure-Torsion-Processed Fe–21cr–5al Alloy, Maalavan Arivu, Andrew Hoffman, Jiaqi Duan, Jonathan Poplawsky, Xinchang Zhang, Frank W. Liou, Rinat Islamgaliev, Ruslan Valiev, Haiming Wen Jan 2023

Comparison Of The Thermal Stability In Equal-Channel-Angular-Pressed And High-Pressure-Torsion-Processed Fe–21cr–5al Alloy, Maalavan Arivu, Andrew Hoffman, Jiaqi Duan, Jonathan Poplawsky, Xinchang Zhang, Frank W. Liou, Rinat Islamgaliev, Ruslan Valiev, Haiming Wen

Mechanical and Aerospace Engineering Faculty Research & Creative Works

Nanostructured Steels Are Expected to Have Enhanced Irradiation Tolerance and Improved Strength. However, They Suffer from Poor Microstructural Stability at Elevated Temperatures. in This Study, Fe–21Cr–5Al–0.026C (Wt%) Kanthal D (KD) Alloy Belonging to a Class of (FeCrAl) Alloys Considered for Accident-Tolerant Fuel Cladding in Light-Water Reactors is Nanostructured using Two Severe Plastic Deformation Techniques of Equal-Channel Angular Pressing (ECAP) and High-Pressure Torsion (HPT), and their Thermal Stability between 500–700 °C is Studied and Compared. ECAP KD is Found to Be Thermally Stable Up to 500 °C, Whereas HPT KD is Unstable at 500 °C. Microstructural Characterization Reveals that ECAP KD …

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Static I-V Based Pim Evaluation For Spring And Fabric-Over-Foam Contacts, Kalkidan W. Anjajo, Yang Xu, Shengxuan Xia, Yuchu He, Haicheng Zhou, Hanfeng Wang, Jonghyun Park, Chulsoon Hwang Jan 2023

Static I-V Based Pim Evaluation For Spring And Fabric-Over-Foam Contacts, Kalkidan W. Anjajo, Yang Xu, Shengxuan Xia, Yuchu He, Haicheng Zhou, Hanfeng Wang, Jonghyun Park, Chulsoon Hwang

Mechanical and Aerospace Engineering Faculty Research & Creative Works

Spring Clips and Fabric-Over-Foams (FOFs) Are Widely Used in Mobile Devices for Electrical Connection Purposes. However, the Imperfect Metallic Connections Tend to Induce Passive Intermodulation (PIM), Resulting in a Receiver Sensitivity Degradation, Known as RP Desensitization. Due to the Complexity of the PIM Characterization, there is Not Yet a Way to Evaluate PIM Performance using a Simple Setup for Environments Like Factories. in This Paper, a Current-Voltage (I-V) Behavior-Based PIM Evaluation Method is Proposed and Validated with Various Metallic Contacts and Contact Forces. the Test Results Demonstrated the Feasibility of the PIM Performance Evaluation based on the Measured Static I-V …

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Correction: Modeling Phase Selection And Extended Solubility In Rapid Solidified Alloys (Metallurgical And Materials Transactions A, (2023), 10.1007/S11661-023-07221-7), Azeez Akinbo, Yijia Gu Jan 2023

Correction: Modeling Phase Selection And Extended Solubility In Rapid Solidified Alloys (Metallurgical And Materials Transactions A, (2023), 10.1007/S11661-023-07221-7), Azeez Akinbo, Yijia Gu

Mechanical and Aerospace Engineering Faculty Research & Creative Works

In the original online version of this article the reference citation in Fig. 3b was incorrect. The original article was corrected.

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Application Of A Variable Path Length Repetitive Process Control For Direct Energy Deposition Of Thin-Walled Structures, Elias B. Snider, Douglas A. Bristow Jan 2023

Application Of A Variable Path Length Repetitive Process Control For Direct Energy Deposition Of Thin-Walled Structures, Elias B. Snider, Douglas A. Bristow

Mechanical and Aerospace Engineering Faculty Research & Creative Works

Direct Energy Deposition (DED) Additive Manufacturing is Well Suited to Fabricating Large Thin-Walled Metal Structures Such as Rocket Nozzles but Suffers from Layer-To-Layer Defect Propagation. Propagating Defects May Exhibit as Slumping or a Ripple in Bead Geometry. Recent Works Have Used Repetitive Process Control (RPC) Methods for Additive Manufacturing to Stabilize the Layer-Wise Defect Propagation, But These Methods Require Repetition of the Same Path. However, Typical Thin-Wall DED Applications, Sometimes Referred to as Vase Structures, Have Changing Paths with Each Layer Such as Expanding or Contracting Diameters and Changing Profiles. This Paper Presents an Extension to Optimal RPC that Uses …

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Reinforcement Learning-Guided Quadratically Constrained Quadratic Programming For Enhanced Convergence And Optimality, Chaoying Pei, Zhi Xu, Sixiong You, Jeffrey Sun, Ran Dai Jan 2023

Reinforcement Learning-Guided Quadratically Constrained Quadratic Programming For Enhanced Convergence And Optimality, Chaoying Pei, Zhi Xu, Sixiong You, Jeffrey Sun, Ran Dai

Mechanical and Aerospace Engineering Faculty Research & Creative Works

In the context of Quadratically Constrained Quadratic Programming (QCQP) with dynamic parameters, the effectiveness of various optimization approaches is heavily influenced by the quality of the initial guess. To address this challenge, this paper proposes a novel approach that leverages reinforcement learning (RL) to generate high-performing initial guesses for iterative algorithms, with the dynamic parameters serving as inputs. Our approach aims to accelerate convergence and improve the objective value, thereby enabling efficient and effective solutions to the QCQP problem under variability. In this study, we evaluate the proposed approach by applying it to an iterative algorithm, specifically the Iterative Rank …

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Mixed-Input Learning For Multi-Point Landing Guidance With Hazard Avoidance Part Ii: Learning-Based Guidance Algorithm, Sixiong You, Chaoying Pei, Vinay Kenny, Ran Dai, Jeremy R. Rea Jan 2023

Mixed-Input Learning For Multi-Point Landing Guidance With Hazard Avoidance Part Ii: Learning-Based Guidance Algorithm, Sixiong You, Chaoying Pei, Vinay Kenny, Ran Dai, Jeremy R. Rea

Mechanical and Aerospace Engineering Faculty Research & Creative Works

This paper investigates the three-dimensional (3D) multi-point landing guidance (MLG) problem with hazard avoidance by developing a mixed-input learning-based method to achieve precise and fuel-efficient planetary landing in future Mars missions. Specifically, we aim to find a safe, fuel-efficient landing point and generate a fuel-optimal trajectory simultaneously in real-time. First, by introducing binary variables, the MLG problem is formulated as an optimal control problem with quadratic constraints. Then, by formulating the Hamiltonian function, the necessary conditions of optimality for the MLG problem are obtained, where the critical parameters are identified to represent the complete optimal solution. After that, to find …

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Feature-Based Learning For Optimal Abort Guidance, Vinay Kenny, Sixiong You, Godfrey Hendrix, Chaoying Pei, Roha Gul, Ran Dai, Jeremy R. Rea Jan 2023

Feature-Based Learning For Optimal Abort Guidance, Vinay Kenny, Sixiong You, Godfrey Hendrix, Chaoying Pei, Roha Gul, Ran Dai, Jeremy R. Rea

Mechanical and Aerospace Engineering Faculty Research & Creative Works

The abort mission refers to the mission where the landing vehicle needs to terminate the landing mission when an anomaly happens and be safely guided to the desired orbit. This paper focuses on solving the time-optimal abort guidance (TOAG) problem in real-time via the feature-based learning method. First, according to the optimal control theory, the features are identified to represent the optimal solutions of TOAG using a few parameters. After that, a sufficiently large dataset of time-optimal abort trajectories is generated offline by solving the TOAG problems with different initial conditions. Then the features are extracted for all generated cases. …

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Distributed Optimization For Rank-Constrained Semidefinite Programs, Chaoying Pei, Sixiong You, Chuangchuang Sun, Ran Dai Jan 2023

Distributed Optimization For Rank-Constrained Semidefinite Programs, Chaoying Pei, Sixiong You, Chuangchuang Sun, Ran Dai

Mechanical and Aerospace Engineering Faculty Research & Creative Works

This letter develops a distributed optimization framework for solving the rank-constrained semidefinite programs (RCSPs). Since the rank constraint is non-convex and discontinuous, solving an optimization problem with rank constraints is NP-hard and notoriously time-consuming, especially for large-scale RCSPs. In the proposed approach, by decomposing an unknown matrix into a set of submatrices with much smaller sizes, the rank constraint on the original matrix is equivalently transformed into a set of constraints on the decomposed submatrices. The distributed framework allows parallel computation of subproblems while requiring coordination among them to satisfy the coupled constraints. As the scale of every subproblem solved …

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Orbital Stabilization Of Underactuated Systems Using Time Period Regulation, Nilay Kant, Ranjan Mukherjee Jan 2023

Orbital Stabilization Of Underactuated Systems Using Time Period Regulation, Nilay Kant, Ranjan Mukherjee

Mechanical and Aerospace Engineering Faculty Research & Creative Works

A new approach to orbital stabilization of under-actuated systems with one passive degree-of-freedom (DOF) is presented. Virtual holonomic constraints are enforced using partial feedback linearization; this results in a dense set of periodic orbits on a constraint manifold. Every orbit on the constraint manifold is associated with a unique time-period. A desired orbit is selected, and the impulse controlled Poincaré map (ICPM) approach is utilized to stabilize the orbit by regulating the time-period. By treating the time period as the output, it is possible to design a dead-beat controller that achieves orbital stabilization in a single time-step. The effectiveness of …

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Thermal And Electrical Properties Of Spark Plasma Sintered (Ti,Cr)B2 Ceramics, Steven M. Smith, Lun Feng, William Fahrenholtz, Gregory E. Hilmas, Laura Silvestroni Jan 2023

Thermal And Electrical Properties Of Spark Plasma Sintered (Ti,Cr)B2 Ceramics, Steven M. Smith, Lun Feng, William Fahrenholtz, Gregory E. Hilmas, Laura Silvestroni

Mathematics and Statistics Faculty Research & Creative Works

Thermal and electrical properties were measured for TiB2 ceramics containing varying CrB2 contents up to 33 mol%. The room-temperature thermal diffusivity decreased with increasing Cr content from 0.330 ± 0.003 cm2/s for pure TiB2 to 0.060 ± 0.003 cm2/s for (Ti0.66Cr0.33)B2. The amount of anisotropy in the coefficients of thermal expansion increased with increasing Cr content and the c-axis had the greatest dependence on Cr addition, with an increase of more than 25% in the thermal expansion for 33 mol% CrB2 compared to TiB2, whereas the a-axis only increased by about 8%. The electrical conductivity was the lowest for (Ti0.66Cr0.33)B2 …

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Comprehensive Evaluation Of A Novel Re-Crosslinkable Preformed Particle Gel For The Water Management Of Reservoir With Concentrated Divalent Ions, Tao Song, Mohamed Ahdaya, Zhanmiao Zhai, Thomas P. Schuman, Baojun Bai Jan 2023

Comprehensive Evaluation Of A Novel Re-Crosslinkable Preformed Particle Gel For The Water Management Of Reservoir With Concentrated Divalent Ions, Tao Song, Mohamed Ahdaya, Zhanmiao Zhai, Thomas P. Schuman, Baojun Bai

Chemistry Faculty Research & Creative Works

As one of the most widely used technology to ameliorate the reservoir's heterogeneity, polymer gels have been applied for more than 60 years. However, how to plug fractured reservoirs with significant abnormal features, high temperature and high salinity, especially the divalent cations, is still a challenging target. This work systematically evaluated a novel salt-resistant re-crosslinkable preformed particle gel (SR-RPPG) designed for fractured reservoirs with excellent salt resistance (up to 5 % CaCl2). We evaluated the swelling kinetics, thermal stability and plugging efficiency of this SR-RPPG. We assessed the swelling kinetic and re-crosslinking behavior of the SR-RPPG through the …

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Temperature Dependence Of The Electronic Absorption Spectrum Of No2, Steve Ndengué, Ernesto Quintas Sánchez, Richard Dawes, Christopher C. Blackstone, David L. Osborn Jan 2023

Temperature Dependence Of The Electronic Absorption Spectrum Of No2, Steve Ndengué, Ernesto Quintas Sánchez, Richard Dawes, Christopher C. Blackstone, David L. Osborn

Chemistry Faculty Research & Creative Works

The nitrogen dioxide (NO2) radical is composed of the two most abundant elements in the atmosphere, where it can be formed in a variety of ways including combustion, detonation of energetic materials, and lightning. Relevant also to smog and ozone cycles, together these processes span a wide range of temperatures. Remarkably, high-resolution NO2 electronic absorption spectra have only been reported in a narrow range below about 300 K. Previously, we reported [ J. Phys. Chem. A 2021, 125, 5519−5533 ] the construction of quasi-diabatic potential energy surfaces (PESs) for the lowest four electronic states (X̃, Ã, B̃, …

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Inter-Rater Agreement For The Annotation Of Neurologic Signs And Symptoms In Electronic Health Records, Chelsea Oommen, Quentin Howlett-Prieto, Michael D. Carrithers, Daniel B. Hier Jan 2023

Inter-Rater Agreement For The Annotation Of Neurologic Signs And Symptoms In Electronic Health Records, Chelsea Oommen, Quentin Howlett-Prieto, Michael D. Carrithers, Daniel B. Hier

Chemistry Faculty Research & Creative Works

The extraction of patient signs and symptoms recorded as free text in electronic health records is critical for precision medicine. Once extracted, signs and symptoms can be made computable by mapping to signs and symptoms in an ontology. Extracting signs and symptoms from free text is tedious and time-consuming. Prior studies have suggested that inter-rater agreement for clinical concept extraction is low. We have examined inter-rater agreement for annotating neurologic concepts in clinical notes from electronic health records. After training on the annotation process, the annotation tool, and the supporting neuro-ontology, three raters annotated 15 clinical notes in three rounds. …

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Topology Driven And Soft Phonon Mode Enabled Na-Ion Diffusion In Quaternary Chalcogenides, Na3zngax4 (X = S, And Se), Sajan Kumar, Mayanak K. Gupta, Ranjan Mittal, Santhoshkumar Sundaramoorthy, Amitava Choudhury, Naresh C. Osti, Alexander I. Kolesnikov, Matthew B. Stone, Yongqiang Cheng, Samrath L. Chaplot Jan 2023

Topology Driven And Soft Phonon Mode Enabled Na-Ion Diffusion In Quaternary Chalcogenides, Na3zngax4 (X = S, And Se), Sajan Kumar, Mayanak K. Gupta, Ranjan Mittal, Santhoshkumar Sundaramoorthy, Amitava Choudhury, Naresh C. Osti, Alexander I. Kolesnikov, Matthew B. Stone, Yongqiang Cheng, Samrath L. Chaplot

Chemistry Faculty Research & Creative Works

The compounds Na3ZnGaX4 (X = S, Se) are potential solid electrolyte materials in sodium-based batteries, which have certain advantages over oxide materials and have shown significant ionic conductivity at ambient temperature. In this paper, we bring out atomic-level features of the diffusion process in these new materials using the microscopic techniques of inelastic neutron scattering (INS), Quasi elastic neutron scattering (QENS), and ab initio molecular dynamics (AIMD) simulations. The insights obtained from these techniques are unique and not available from other macroscopic experiments. Neutron scattering experiments have been performed at temperatures from 100 to 700 K. The simulations have been …

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Nmr Study Of Co2 Capture By Butylamine And Oligopeptide Kdde In Aqueous Solution: Capture Efficiency And Gibbs Free Energy Of The Capture Reaction As A Function Of Ph**, Kaidi Yang, Joseph Schell, Fabio Gallazzi, Wei Wycoff, Rainer Glaser Jan 2023

Nmr Study Of Co2 Capture By Butylamine And Oligopeptide Kdde In Aqueous Solution: Capture Efficiency And Gibbs Free Energy Of The Capture Reaction As A Function Of Ph**, Kaidi Yang, Joseph Schell, Fabio Gallazzi, Wei Wycoff, Rainer Glaser

Chemistry Faculty Research & Creative Works

We Have Been Interested in the Development of Rubisco-Based Biomimetic Systems for Reversible CO2 Capture from Air. Our Design of the Chemical CO2 Capture and Release (CCR) System is Informed by the Understanding of the Binding of the Activator CO2 (ACO2) in Rubisco (Ribulose-1,5-Bisphosphate Carboxylase/oxygenase). the Active Site Consists of the Tetrapeptide Sequence Lys-Asp-Asp-Glu (Or KDDE) and the Lys Sidechain Amine is Responsible for the CO2 Capture Reaction. We Are Studying the Structural Chemistry and the Thermodynamics of CO2 Capture based on the Tetrapeptide CH3CO−KDDE−NH2 ("KDDE") in Aqueous …

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Enhancing Innovation Via The Digital Twin, Nobuyuki Fukawa, Aric Rindfleisch Jan 2023

Enhancing Innovation Via The Digital Twin, Nobuyuki Fukawa, Aric Rindfleisch

Business and Information Technology Faculty Research & Creative Works

A Growing Number of Firms Are Seeking to Leverage Emerging Technologies, Such as Artificial Intelligence (AI) and 3D Printing, to Enhance their Innovation Efforts. These Seemingly Distinct Technologies Are Currently Coalescing into an Encompassing New Technology Called the Digital Twin. This Technology Allows Innovative Firms to Create a Digital Replica of a Physical Entity that Evolves over its Life Cycle. This Article Explores the Implications of the Digital Twin for Innovation Theory and Practice. First, We Examine the Connection between the Digital Twin and Three Related Technologies (I.e., 3D Printing, Big Data, and AI). Second, We Create a Typology of …

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Motivators And Inhibitors For Business Analytics Adoption From The Cross-Cultural Perspectives: A Data Mining Approach, Hokey Min, Bih-Ru Lea Jan 2023

Motivators And Inhibitors For Business Analytics Adoption From The Cross-Cultural Perspectives: A Data Mining Approach, Hokey Min, Bih-Ru Lea

Business and Information Technology Faculty Research & Creative Works

In the increasingly knowledge-based world economy, the multinational firm's success often hinges on its business intelligence capability nurtured by business analytics (BA). Despite the growing recognition of BA's role in enhancing the firm's intellectual capital and subsequent competitiveness, it is still unknown what truly motivates and inhibits BA adoption. This study aims to identify key influencing factors for BA adoption such as organizational characteristics, information security/privacy, and information technology maturity (knowledge level). In so doing, this study employed data mining and data visualization techniques to develop specific patterns of BA adoption practices based on a combined sample of 224 Korean …

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Generative Ai And Chatgpt: Applications, Challenges, And Ai-Human Collaboration, Fiona Fui-Hoon Nah, Ruilin Zheng, Jingyuan Cai, Keng Siau, Langtao Chen Jan 2023

Generative Ai And Chatgpt: Applications, Challenges, And Ai-Human Collaboration, Fiona Fui-Hoon Nah, Ruilin Zheng, Jingyuan Cai, Keng Siau, Langtao Chen

Business and Information Technology Faculty Research & Creative Works

No abstract provided.

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Security Is Local: The Influence Of The Immediate Workgroup On Information Security, Dawei David Wang, Alexandra Durcikova, Alan R. Dennis Jan 2023

Security Is Local: The Influence Of The Immediate Workgroup On Information Security, Dawei David Wang, Alexandra Durcikova, Alan R. Dennis

Business and Information Technology Faculty Research & Creative Works

Information security is a multilevel phenomenon with employee security decisions being influenced by macrolevel factors (e.g., organizational policies), mesolevel factors (e.g., one's immediate workgroup—IW), and microlevel factors (e.g., individual personalities). We argue that an employee's local IW (i.e., immediate supervisor and coworkers) has a strong effect on security. This paper focuses on the effects of these mesolevel factors in the presence of macro-and microlevel factors. Drawing on the social structure and social learning framework as well as workgroup research, we hypothesize that the security behavior of an employee's IW supervisor and coworkers moderated by the nature of these relationships influences …

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