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Articles 511 - 540 of 17264
Full-Text Articles in Entire DC Network
Simulating Realistic Lyman-š¼ Emitters Including The Effect Of Radiative Transfer, Hasti Khoraminezhad, Shun Saito, Max Gronke, Chris Byrohl
Simulating Realistic Lyman-š¼ Emitters Including The Effect Of Radiative Transfer, Hasti Khoraminezhad, Shun Saito, Max Gronke, Chris Byrohl
Research Data
We present an empirical yet physically motivated simulation of realistic Lyman-š¼ emitters (LAEs) at š§ ā¼ 2 ā 3, crucial for ongoing and forthcoming cosmological LAE surveys. We combine an empirical UniverseMachine galaxy-halo model with a simple spherical expanding shell model for the Lyman-š¼ radiative transfer, calibrating only three free parameters to simultaneously reproduce the observed Lyman-š¼ luminosity function and the angular clustering. Our LAE model is further supported by its consistency with other observables such as the Lyman-š¼ equivalent width distribution, the Lyman-š¼ escape fraction as a function of stellar mass and dust reddening, and the systemic velocity offsets. ā¦
Synergistic Doping And Coating Strategy For Boosting Na0.7mno2 Cathode Performance In Sodium-Ion Batteries, Ahmad Helaley, Han Yu, Manashi Nath, Xinhua Liang
Synergistic Doping And Coating Strategy For Boosting Na0.7mno2 Cathode Performance In Sodium-Ion Batteries, Ahmad Helaley, Han Yu, Manashi Nath, Xinhua Liang
Chemistry Faculty Research & Creative Works
Advancing sodium-ion battery (SIB) technology requires novel approaches to optimize cathode materials for improved electrochemical performance. In this study, we employ atomic layer deposition (ALD) to precisely modify the surface of P2-type Na0.7MnO2 cathodes with different coating materials including ZnO, NiO, and Al2O3, followed by post-annealing at 750Ā°C for 10 hours. The strategic combination of ALD and thermal treatment can achieve thin film coating on particle surface and promote element doping into the near-surface lattice, as confirmed by electron energy loss spectroscopy (EELS) analysis. The incorporation of Zn, Al, and Ni results in ā¦
Unraveling Hydration- And Temperature-Induced Structural Transformations Of Linear Poly(Ethylenimine) Using Raman Microscopy And Numerical Unmixing, Miharu Koh, Jay P. Kitt, Andrew D. Pendergast, Joel M. Harris, Shelley D. Minteer, Carol Korzeniewski
Unraveling Hydration- And Temperature-Induced Structural Transformations Of Linear Poly(Ethylenimine) Using Raman Microscopy And Numerical Unmixing, Miharu Koh, Jay P. Kitt, Andrew D. Pendergast, Joel M. Harris, Shelley D. Minteer, Carol Korzeniewski
Chemistry Faculty Research & Creative Works
Linear poly(ethylenimine) (LPEI) is a hydration-sensitive polymer of interest for its breadth of application in areas that include medicine, energy, and materials science. To facilitate advances, this work demonstrates in situ Raman microscopy and self-modeling curve resolution (SMCR) analysis as an approach for investigating changes in LPEI structure during melting and crystallization under controlled heating and cooling conditions. With focus on neutral (freebase) LPEI, SMCR analysis of Raman data sets showed that the melting transition of anhydrous LPEI was well described by a pair of spectral vectors representing anhydrous crystalline and amorphous states. However, the transition from the melted to ā¦
Comparative Study Of Interfacial Bond Strength Of Steel H-Pile With Ultra-High Performance And Polymer Concrete Jacket, Binod Shrestha, Mohanad M. Abdulazeez, Mohamed A. Elgawady
Comparative Study Of Interfacial Bond Strength Of Steel H-Pile With Ultra-High Performance And Polymer Concrete Jacket, Binod Shrestha, Mohanad M. Abdulazeez, Mohamed A. Elgawady
Civil, Architectural and Environmental Engineering Faculty Research & Creative Works
This study investigates the bond behavior of steel H-pile encased in concrete jackets under push-out loading, considering the effects of concrete type and embedment length. Nine full-scale specimens were tested using three concrete types: ultra-high-performance concrete (UHPC), Methyl Methacrylate Polymer Concrete (MMA-PC), and conventional concrete (CC), with embedment lengths of 63.5 mm, 127 mm, and 190.5 mm. The experimental results revealed that MMA-PC jacket demonstrated the highest bond strength, though gains were marginal beyond 127 mm. UHPC exhibited superior tensile strength and ductility, preventing splitting failure. UHPC also displayed the highest interfacial fracture energy of 9.63 N/mm, exceeding MMA-PC and ā¦
Treatment Intensification Of Digester Dewatering Sidestreams Via Pilot- And Demonstration-Scale Revolving Algal Biofilms At Municipal Water Resource Recovery Facilities, Audrey E. Kocher, Hunter W. Schroer, Christopher A. Marks, Craig L. Just
Treatment Intensification Of Digester Dewatering Sidestreams Via Pilot- And Demonstration-Scale Revolving Algal Biofilms At Municipal Water Resource Recovery Facilities, Audrey E. Kocher, Hunter W. Schroer, Christopher A. Marks, Craig L. Just
Civil, Architectural and Environmental Engineering Faculty Research & Creative Works
As water resource recovery facilities (WRRFs) pursue decarbonization, the treatment of concentrated side streams from anaerobic digestion offers a critical opportunity to reduce energy use and greenhouse gas emissions. This study evaluated the intensification potential of revolving algal biofilms (RAB) for side stream nutrient removal via partial nitrification at pilot- and demonstration-scales. RAB systems were deployed at municipal WRRFs in Boulder and Iowa City, treating real dewatering side streams across a range of ammonium (NH4+āN) surface area loading rates (SALR) reaching up to 196 g N mā2dā2. The results demonstrated that RAB systems can ā¦
Elucidating The Effects Of Water Activity On The Hydration Kinetics And Thermodynamics Of YeāElimiteāCalcium Sulfate Hydrate Systems, Godwin I. Ogbuehi, Rupack R. Halder, Aditya Kumar, Gaurav Sant, Monday U. Okoronkwo
Elucidating The Effects Of Water Activity On The Hydration Kinetics And Thermodynamics Of YeāElimiteāCalcium Sulfate Hydrate Systems, Godwin I. Ogbuehi, Rupack R. Halder, Aditya Kumar, Gaurav Sant, Monday U. Okoronkwo
Materials Science and Engineering Faculty Research & Creative Works
Relative humidity and water activity (aH) reductions have been known to suppress the hydration of anhydrous cement clinker phases. However, the relationship between ye'elimite (C4A3$) hydration kinetics and water activity remain unclear. This study employs experimental and thermodynamic modeling approaches to investigate the influence of water activity on ye'elimite hydration in the "C4A3$ + water", and "C4A3$ + gypsum + water" systems. Experimental findings indicate that as water activity decreases, C4A3$ hydration diminishes until the reaction is brought to a halt at a threshold aH. The critical aHand corresponding solubility constant of C4A3$ (KC4A3SĀÆ) estimated from thermodynamic analysis are 0.46 ā¦
Quantum Phase Coherent Tunneling In A Mixed-Morphology Superlattice Heterostructure, Qing Shao, Can C. Aygen, Xianyu Chen, Woongkyu Lee, Robert P.H. Chang, Julia E. Medvedeva, Matthew A. Grayson
Quantum Phase Coherent Tunneling In A Mixed-Morphology Superlattice Heterostructure, Qing Shao, Can C. Aygen, Xianyu Chen, Woongkyu Lee, Robert P.H. Chang, Julia E. Medvedeva, Matthew A. Grayson
Physics Faculty Research & Creative Works
Multilayer phase coherence is demonstrated in a mixed morphology superlattice heterostructure, generalizing the paradigm for superlattice miniband engineering. Thirty years since the original proposal by Tsu, a superlattice has been realized with alternating amorphous (a-MoO3) and polycrystalline (pc-In2O3) layers, whose high-quality exhibits quantum phase coherence across multiple periods of amorphous barriers. Cross-plane phase coherence is quantified via weak localization signatures in magnetic field under the diffusive Fermi-surface model.
Effects OfĀ Yttrium AndĀ Barium Trace Impurities OnĀ TheĀ Dielectric Properties OfĀ Srtio3 (111) Single Crystals AtĀ Cryogenic Temperatures, Hung Trinh, Alan Devoe, Fatih Dogan
Effects OfĀ Yttrium AndĀ Barium Trace Impurities OnĀ TheĀ Dielectric Properties OfĀ Srtio3 (111) Single Crystals AtĀ Cryogenic Temperatures, Hung Trinh, Alan Devoe, Fatih Dogan
Materials Science and Engineering Faculty Research & Creative Works
Commercially available single crystals of (111) SrTiO3Ā were found to contain impurities of varying amounts that strongly affected their dielectric performance at cryogenic temperatures. Three crystals with total impurities of 111, 126, and 625 ppm, primarily of barium and yttrium, were analyzed. Relative permittivity (Īµr) and loss tangent were investigated with high resolution as a function of temperature (4 K to 100 K), DC voltage (0 V/cm to 800 V/cm), and frequency (100 Hz to 1 MHz). An impurity level as low as ā500 ppm barium resulted in an increase of the maximum permittivity (Īµm) to approximately 50,000 at ā¦
Enhanced The Simultaneous Recovery/Extraction Of Combined Heavy Metals Of Lead And Vanadium From Synthetic Wastewater Using An Emulsion Liquid Membrane (Elm) With Nanoparticles And Ionic Liquid, Qusay Al-Obaidi, Nora Yehia Selem, Oumaima Karai, Kaoutar Benabderazak, Muthanna H. Al-Dahhan
Enhanced The Simultaneous Recovery/Extraction Of Combined Heavy Metals Of Lead And Vanadium From Synthetic Wastewater Using An Emulsion Liquid Membrane (Elm) With Nanoparticles And Ionic Liquid, Qusay Al-Obaidi, Nora Yehia Selem, Oumaima Karai, Kaoutar Benabderazak, Muthanna H. Al-Dahhan
Chemical and Biochemical Engineering Faculty Research & Creative Works
Recovery/extracting of a combination of lead (Pb(II)) and vanadium (V(V)) ions from wastewater has been enhanced by an emulsion liquid membrane with the presence of magnesium oxide (MgO) or aluminum oxide (Al2O3) nanoparticles (20ā50 nm size range) in the internal/stripping phase (W1) and ionic liquid ([OMIM] PF6) in the organic/oil phase (O). The study found that the recovery/extraction batch time was shortened, enhancing emulsion extraction efficiency and stability. Furthermore, the study outcomes extend the ELM separation techniques to industrial-scale pollutant recovery/extraction applications, especially heavy metal ions, from industrial effluent. The percentage of Pb(II) recovery/extraction was increased ā¦
Bioaccumulation Pattern Of Per- And Polyfluoroalkyl Substances (Pfas) In Fish Tissues From Two Freshwater Systems, Margaret D. Taiwo, Husam Kafeenah, David D. Duvernell, Michael O. Eze
Bioaccumulation Pattern Of Per- And Polyfluoroalkyl Substances (Pfas) In Fish Tissues From Two Freshwater Systems, Margaret D. Taiwo, Husam Kafeenah, David D. Duvernell, Michael O. Eze
Biological Sciences Faculty Research & Creative Works
Per- and polyfluoroalkyl substances (PFAS) are known for their persistence, ubiquity, bioaccumulation in different matrices of the environment and their detrimental effect on human health. In this study, we used EPA 1633 to examine the prevalence of ten PFAS compounds in two freshwater systems and investigated their bioaccumulation pattern across different tissues of grass carp fish (Ctenopharyngodon idella), common carp (Cyprinus carpio), and flathead catfish (Pylodictis olivaris). Among the PFAS compounds analyzed, PFBS exhibited the highest concentration in the freshwater sample, exceeding the U.S. EPA regulatory limit of 4 ng/L for drinking water. The total PFAS concentrations in the muscle, ā¦
A Comprehensive Overview Of Chronic Wound Infections And Current Treatment Methods, Sarah Fakher, David J. Westenberg
A Comprehensive Overview Of Chronic Wound Infections And Current Treatment Methods, Sarah Fakher, David J. Westenberg
Biological Sciences Faculty Research & Creative Works
Chronic wound infections pose significant healthcare challenges due to persistent biofilms, antibiotic resistance, and impaired healing pathways. These wounds are characterized by prolonged inflammation, microbial colonization, and disrupted tissue regeneration, leading to substantial morbidity and healthcare costs. This article reviews current knowledge on chronic wound types, their pathophysiology, and the mechanisms underlying biofilm formation to examine the latest advancements in antimicrobial-based strategies aimed at addressing these challenges. It highlights how diverse materials and technologies have been engineered to improve infection management, enhance tissue regeneration, and overcome the limitations of traditional treatments as well as advances that leverage innovations such as ā¦
Bending Fatigue In Additively Manufactured Metals: A Review Of Current Research And Future Directions, Md Bahar Uddin, Sriram Praneeth Isanaka, Frank Liou
Bending Fatigue In Additively Manufactured Metals: A Review Of Current Research And Future Directions, Md Bahar Uddin, Sriram Praneeth Isanaka, Frank Liou
Mechanical and Aerospace Engineering Faculty Research & Creative Works
Metal additive manufacturing (MAM), also referred to as 3D printing, has proven remarkable in the fabrication of complex metal components in multiple sectors. However, the assessment of this revolutionary process through bending fatigue is frequently impeded due to concerns about mechanical and physical conditions of the printed components. The unique layer-by-layer production process results in varied microstructures, anisotropy, and intrinsic defects that considerably differ from traditionally manufactured wrought metals. This review article aims to integrate and evaluate historical and contemporary research on the bending fatigue of additively manufactured materials. More specifically, the impact of process parameters, build orientation, surface conditions, ā¦
Comparative Fire Hazards Of Lithium-Ion Battery Chemistries: Linking Thermal Behavior, Gas Toxicity, And State-Of-Charge To Composite Risk Profiles, Aamir Iqbal, Ashish Kakoria, Syed Talha Riaz, Jingmin Xu, Robert Illango Pushparaj, Guang Xu
Comparative Fire Hazards Of Lithium-Ion Battery Chemistries: Linking Thermal Behavior, Gas Toxicity, And State-Of-Charge To Composite Risk Profiles, Aamir Iqbal, Ashish Kakoria, Syed Talha Riaz, Jingmin Xu, Robert Illango Pushparaj, Guang Xu
Mining Engineering Faculty Research & Creative Works
Lithium-ion batteries (LIB) are widely used in electric vehicles (EVs) for their high energy density. However, their fire safety causes concerns because of the toxic gases emission and the challenge to extinguish. The type and quantity of toxic gases released during battery fires remain among the least studied hazards, with limited data available despite their serious health risks. This study examines the thermal and gaseous emission behavior of LIB cells after thermal runaway (TR). Five cell types, Lithium Iron Phosphate (LFP), Lithium Titanate (LTO), and three Lithium Nickel Manganese Cobalt oxide (NMC). The three NMC variants share the same base ā¦
Energy-Harvesting Concurrent Lora Mesh With Timing Offsets For Underground Mine Emergency Communications, Hilary Kelechi Anabi, Samuel Frimpong, Sanjay Madria
Energy-Harvesting Concurrent Lora Mesh With Timing Offsets For Underground Mine Emergency Communications, Hilary Kelechi Anabi, Samuel Frimpong, Sanjay Madria
Mining Engineering Faculty Research & Creative Works
Underground mine emergencies destroy communication infrastructure when situational awareness is most critical. Current systems rely on centralized network infrastructure, which fails during emergencies when miners are trapped and require rescue coordination. This paper proposes an energy-harvesting LoRa mesh network that addresses self-powered operation, interference management, and adaptive physical layer optimization under severe underground propagation conditions. A dual-antenna architecture separates RF energy harvesting (860 MHz) from LoRa communication (915 MHz), enabling continuous operation with supercapacitor storage. The core contribution is a decentralized scheduler that derives optimal timing offsets by modeling concurrent transmissions as a Poisson collision process, exploiting LoRa's capture effect ā¦
Harnessing Coherent-Wave Control For Sensing Applications, Pablo Jara, Arthur Goetschy, Hui Cao, Alexey Yamilov
Harnessing Coherent-Wave Control For Sensing Applications, Pablo Jara, Arthur Goetschy, Hui Cao, Alexey Yamilov
Physics Faculty Research & Creative Works
Imaging techniques such as functional near-infrared spectroscopy and diffuse optical tomography (DOT) achieve deep, noninvasive sensing in turbid media; however, they are constrained by the photon budget, as most of the injected light is lost to scattering before reaching the detector. Wavefront shaping (WFS) can enhance signal strength via interference at specific locations within scattering media, enhancing light-matter interactions and potentially extending the penetration depth of these techniques. Interpretation of the resulting measurements relies on knowing the optical sensitivity - the relationship between changes in the detected signals and perturbations at a specific location inside the medium; however, conventional diffusion-based ā¦
Multicomponent One-Dimensional Quantum Droplets Across The Mean-Field Stability Regime, I. A. Englezos, P. Schmelcher, S. I. Mistakidis
Multicomponent One-Dimensional Quantum Droplets Across The Mean-Field Stability Regime, I. A. Englezos, P. Schmelcher, S. I. Mistakidis
Physics Faculty Research & Creative Works
The Lee-Huang-Yang (LHY) energy correction at the edge of the mean-field stability regime is known to give rise to beyond mean-field structures in a wide variety of systems. In this work, we analytically derive the LHY energy for two-, three-and four-component one-dimensional bosonic short-range interacting mixtures across the mean-field stability regime. For varying intercomponent attraction in the two-component setting, quantitative deviations from the original LHY treatment emerge being imprinted in the droplet saturation density and width. On the other hand, for repulsive interactions an unseen early onset of phase-separation occurs for both homonuclear and heteronuclear mixtures. Closed LHY expressions for ā¦
Ded Printing Process Modeling Using Metal Matrix Composites: In-Situ Feedstock Mixing With Variable Compositions And Empirical Validation, Muhammad Arif Mahmood, Sabin Mihai, Diana Chioibasu, Andrei C. Popescu, Frank Liou
Ded Printing Process Modeling Using Metal Matrix Composites: In-Situ Feedstock Mixing With Variable Compositions And Empirical Validation, Muhammad Arif Mahmood, Sabin Mihai, Diana Chioibasu, Andrei C. Popescu, Frank Liou
Mechanical and Aerospace Engineering Faculty Research & Creative Works
Directed Energy Deposition (DED) is a promising technology for producing metal matrix composites (MMXCs), but precise control over deposited layer dimensions, particularly in multi-material systems, remains difficult to achieve due to the complex interdependence of operating parameters such as laser parameters, feedstock flow rate, and beam energy attenuation. To address these problems, this work proposes an analytical model that predicts the width, height, and depth of the deposited layers using mixed feedstock compositions in-situ, with a focus on Inconel-718 and TiC MMXCs. The model takes into account variables such as laser power, feedstock density, and mixing ratios to improve layer ā¦
Powder Bed Fusion Of Stainless Steel 304l-Nbc Nanocomposite Produced By Ball Milling Method Using A Laser Beam, Khalid Hussain Solangi, Junaid Iqbal Bhatti, Irfan Ali Tunio, Imdad Ali Memon, Temoor Abbas Larik, Lianyi Chen
Powder Bed Fusion Of Stainless Steel 304l-Nbc Nanocomposite Produced By Ball Milling Method Using A Laser Beam, Khalid Hussain Solangi, Junaid Iqbal Bhatti, Irfan Ali Tunio, Imdad Ali Memon, Temoor Abbas Larik, Lianyi Chen
Mechanical and Aerospace Engineering Faculty Research & Creative Works
Metal powders with uniformly dispersed nanoparticles, suitable shape, and size for additive manufacturing (AM) processes are highly demanded. However, it is difficult to manufacture metal matrix nanocomposite powders (MMNCs) with uniform dispersion of nanoparticles, optimized shape, and size. This study used high-energy ball milling to disperse NbC nanoparticles with an average length of 400 nm (ex-situ reinforcement) in a Stainless Steel (SS) 304 L matrix. In detail, SS304L-5wt% NbC powders were ball-milled from 4 to 10 h. The results showed that the milled powder particles experienced significant cold-welding during the milling time of 4ā6 h, with a wide size distribution. ā¦
Defect-Driven Degradation Of Mxenes In Aqueous Environments And Mitigation Strategies: Insights From First-Principles, Ana Maria Stratulat, Valentina Nesterova, Vladislav Korostelev, Majid Beidaghi, Vadym Mochalin, Konstantin Klyukin
Defect-Driven Degradation Of Mxenes In Aqueous Environments And Mitigation Strategies: Insights From First-Principles, Ana Maria Stratulat, Valentina Nesterova, Vladislav Korostelev, Majid Beidaghi, Vadym Mochalin, Konstantin Klyukin
Chemistry Faculty Research & Creative Works
MXenes have attracted considerable attention due to their tunable surface chemistry, high electrical conductivity, and ease of solution processing, making them promising candidates for a wide array of applications. The inherent tendency of MXenes to degrade under environmental conditions constrains their compositional diversity and limits certain practical applications. Our computational study shows that degradation of defect-free Ti3C2Txis kinetically limited, whereas common defects markedly lower the activation barriers for water attack. Using ab initio molecular dynamics simulations (AIMD) combined with thermodynamic analysis, we show that titanium vacancies VTiact as active sites for the protonation of subsurface carbon ā¦
Atomistic Insights Into Dual Mechanisms For Nacl-Driven Dissolution And Polymerization Of Tricalcium Silicate, Wei Zhang, Jia Sun, Juntao Dang, Bo Tao Huang, Biqin Dong, Hongyan Ma, Dongshuai Hou
Atomistic Insights Into Dual Mechanisms For Nacl-Driven Dissolution And Polymerization Of Tricalcium Silicate, Wei Zhang, Jia Sun, Juntao Dang, Bo Tao Huang, Biqin Dong, Hongyan Ma, Dongshuai Hou
Civil, Architectural and Environmental Engineering Faculty Research & Creative Works
In this study, experimental characterization and reactive molecular dynamics simulations were integrated to reveal the effects of NaCl on the early hydration of tricalcium silicate (C3S). The results demonstrate that NaCl significantly accelerates the early hydration of C3S by promoting Ca dissolution and silicate tetrahedra polymerization. Specifically, Clāions coordinate with surface Ca, weakening the CaāO bonds in C3S and reducing the energy barrier for Ca dissolution. Meanwhile, Na+ions compete with Ca2+for the O atoms, creating localized charge imbalance and attracting protons, which destabilize SiāO bonds and facilitate the polymerization of silicate tetrahedra. These effects ā¦
Collisional Excitation Of Hcn By Co To Refine The Modeling Of Cometary Comae, Francesca Tonolo, Ernesto Quintas-SƔnchez, Adrian Batista-Planas, Richard Dawes, FranƧois Lique
Collisional Excitation Of Hcn By Co To Refine The Modeling Of Cometary Comae, Francesca Tonolo, Ernesto Quintas-SƔnchez, Adrian Batista-Planas, Richard Dawes, FranƧois Lique
Chemistry Faculty Research & Creative Works
We present the first dataset of collisional (de)-excitation rate coefficients of HCN induced by CO, one of the main perturbing gases in cometary atmospheres. The dataset spans the temperature range of 5ā50 K. It includes both state-to-state rate coefficients involving the lowest ten and nine rotational levels of HCN and CO, respectively, and the so-called "thermalized" rate coefficients over the rotational population of CO at each kinetic temperature. The derivation of these coefficients exploited the good performance of the statistical adiabatic channel model (SACM) on top of an accurate interaction potential computed at the CCSD(T)-F12b/CBS level of theory. The reliability ā¦
Heteroskedastic Ordered Probit Models With An Artificial Neural Network For Predicting Potential Consumer Ratings On Amazon Software Reviews, Jikhan Jeong
Economics Faculty Research & Creative Works
The ordered probit model is widely used to make inferences about ordinal dependent variables in the social sciences, while neural network models have proven effective for classification tasks across various domains. Although other scholars have proposed ordinal classification models using neural networks, empirical studies combining ordered probit models with neural networks remain limited. To date, no studies have examined ordered probit models with neural networks under the assumption of heteroskedasticity. Accordingly, this paper demonstrates the predictive performance of an ordered probit model with an artificial neural network (OPANN) using different activation functions. In addition, it introduces a newly developed heteroskedastic ā¦
Reliable Structures And Electronic Energies Of Small Water Clusters Using Density Functional And Local Correlation Coupled Cluster Model Chemistries, Benjamin T. Petty, Vance R. Fowler, Audrey Ryu, Caroline S. Glick, Carly A. Rock, Qihang Wang, Gregory S. Tschumper, George C. Shields
Reliable Structures And Electronic Energies Of Small Water Clusters Using Density Functional And Local Correlation Coupled Cluster Model Chemistries, Benjamin T. Petty, Vance R. Fowler, Audrey Ryu, Caroline S. Glick, Carly A. Rock, Qihang Wang, Gregory S. Tschumper, George C. Shields
Chemistry Faculty Research & Creative Works
In this paper we have assessed the ability of the domain-based local pair natural orbital (DLPNO)-CCSD(T) method to match the explicitly correlated CCSD(T) relative energies of (H2O)n=3ā7isomers along with the impact of the level of theory utilized to optimize the water cluster geometries. The benchmark structures were optimized using a 2-body:Many-body procedure in which all of the 1- and 2-body contributions are computed using CCSD(T) while all of the higher-order many-body interactions are computed using MP2 (denoted CCSD(T):MP2). Benchmark relative energies were computed for these CCSD(T):MP2 optimized geometries with explicitly correlated CCSD(T)-F12b single point energies (SPEs) using the ā¦
Liquid 1h-1,2,3-Triazole Interpreted As A Continuous, Self-Assembled Hydrogen-Bonded Linear Network, Ashley E. Williams, Anna Craigholan, Leah A. Surbaugh, Aron J. Huckaba, Jared H. Delcamp, Gregory S. Tschumper, Nathan I. Hammer
Liquid 1h-1,2,3-Triazole Interpreted As A Continuous, Self-Assembled Hydrogen-Bonded Linear Network, Ashley E. Williams, Anna Craigholan, Leah A. Surbaugh, Aron J. Huckaba, Jared H. Delcamp, Gregory S. Tschumper, Nathan I. Hammer
Chemistry Faculty Research & Creative Works
The molecular-level organization of 1H-1,2,3-triazole in the liquid state is described as an extended hydrogen-bonded network, reminiscent of linear solution-phase polymer chains. Raman, IR, and no-D NMR spectroscopic data interpreted using density functional theory (DFT) computations reveal no evidence of the lower-energy 2H- tautomer or isolated 1H- monomers. Spectroscopic and computational results are consistent with an extended network of strong intermolecular hydrogen bonds throughout the pure liquid and explain earlier X-ray and solution-phase studies. Our computations indicate that the Gibbs free energy of ring-like structures for the most part increases with the number of fragments whereas it decreases for extended ā¦
Revisiting The SpināLattice Relaxation Of Homonuclear In-Phase And Antiphase Nmr Magnetization, Lauren M. Kehoe, Zachary G. Mayes, Kelsey E. Brakensiek, Emma L. Ellis, Adam J. Alderfer, Lingyu Chi, Klaus Woelk
Revisiting The SpināLattice Relaxation Of Homonuclear In-Phase And Antiphase Nmr Magnetization, Lauren M. Kehoe, Zachary G. Mayes, Kelsey E. Brakensiek, Emma L. Ellis, Adam J. Alderfer, Lingyu Chi, Klaus Woelk
Chemistry Faculty Research & Creative Works
Hyperpolarization techniques such as dynamic nuclear polarization (DNP), chemically induced dynamic nuclear polarization (CIDNP), and parahydrogen-induced polarization (PHIP) enhance the sensitivity of NMR spectroscopy and MRI, but the associated antiphase magnetization patterns often relax faster than those of conventional in-phase signals. This study analyzes the spinālattice relaxation matrix for single-quantum transitions in an isolated, weakly coupled two-spin AX system to identify eigenvectors and eigenvalues that govern the time evolution of in-phase and antiphase longitudinal magnetization. The analysis predicts that AX antiphase magnetization, such as that generated by PHIP hydrogenations in high magnetic field, can relax up to twice as fast ā¦
Reflections: Two Linear B Signs (69, *47) In Light Of The Ancient Egyptian āUnion Of Two Landsā (Sema-Tawy), Gerald Leonard Cohen
Reflections: Two Linear B Signs (69, *47) In Light Of The Ancient Egyptian āUnion Of Two Landsā (Sema-Tawy), Gerald Leonard Cohen
Arts, Languages and Philosophy Faculty Research & Creative Works
This article suggests that two Linear B signs (69, *47) denote āunion,ā specifically the ancient Egyptian āUnion of Two Lands,ā i.e., North and South Egypt. The Egyptian term for this union is sema-taui (from sema āunionā, ta ālandā; -ui ādual; taui ātwo lands'), and the earlier suggestion that sign 69 derives from a picture of a leaf should perhaps be reconsidered in favor of the Egyptian sema-tawy symbol. Also, on a very speculative note I suggest that the Linear B pronunciation of sign 69 as /tu/ may derive from the /t/ and /u/ sounds of taui ātwo lands.ā
Dcrda: Deadline-Constrained Function Scheduling In Serverless-Cloud Platform, Priyanka Ashok Birajdar, Divya Meena, Anurag Satpathy, Sourav Kanti Addya
Dcrda: Deadline-Constrained Function Scheduling In Serverless-Cloud Platform, Priyanka Ashok Birajdar, Divya Meena, Anurag Satpathy, Sourav Kanti Addya
Computer Science Faculty Research & Creative Works
The serverless computing model frees developers from operational and management tasks, allowing them to focus solely on business logic. This paper addresses the computationally challenging function-container-virtual machine (VM) scheduling problem, especially under stringent deadline constraints. We propose a two-stage holistic scheduling framework called DCRDA targeting deadline-constrained function scheduling. In the first stage, the function-to-container scheduling is modeled as a one-to-one matching game and solved using the classical Deferred Acceptance Algorithm (DAA). The second stage addresses the container-to-VM assignment, modeled as a many-to-one matching problem, and solved using a variant of the DAA, the Revised-Deferred Acceptance Algorithm (RDA), to account for ā¦
Laboratory Investigation Of High-Temperature Preformed Particle Gels For Fluid Control In Granite Cores For Geothermal Applications, K. Caleb Darko, Yanbo Liu, Thomas P. Schuman, Mingzhen Wei, Baojun Bai
Laboratory Investigation Of High-Temperature Preformed Particle Gels For Fluid Control In Granite Cores For Geothermal Applications, K. Caleb Darko, Yanbo Liu, Thomas P. Schuman, Mingzhen Wei, Baojun Bai
Chemistry Faculty Research & Creative Works
To understand the applicability of high-temperature preformed particle gel (HT-PPG) for control of short-circuiting in enhanced geothermal systems (EGSs), core flooding experiments were conducted on fractured granite cores under varying fracture widths, gel particle sizes and swelling ratios. Key parameters such as injection pressure, water breakthrough pressure, and residual resistance factor were measured to evaluate HT-PPG performance. The gel exhibited strong injectability, entering granite fractures at pressure gradients as low as 0.656 MPa/m; HT-PPG yields a superior sealing performance by significantly reducing the permeability; and dehydration occurs during HT-PPG propagation, with a dehydration ratio ranging from 4.71% to 11.36%. This ā¦
Evaluation Of Towed Tem Potential For Rapid Characterization Of Levee Foundations, Kolawole Arowoogun, Katherine Grote, Jeremy Maurer
Evaluation Of Towed Tem Potential For Rapid Characterization Of Levee Foundations, Kolawole Arowoogun, Katherine Grote, Jeremy Maurer
Geosciences and Geological and Petroleum Engineering Faculty Research & Creative Works
Assessing the geologic conditions of levee foundation soils is a challenging task owing to the extensive length of most levees and the heterogeneity of many alluvial deposits. Traditional investigation techniques (such as boring and cone penetrometer testing [CPT]) are expensive, invasive, and provide spatially-limited information. As a result, they are restricted to pre-identified problematic zones in the levee. To overcome these challenges, geophysical instruments capable of better spatial coverage are proposed for rapid geoelectrical characterization of levees. In this study, we presented a field-based application of the towed time-domain electromagnetic method (tTEM) system in characterizing the subsurface geology adjacent to ā¦
Tensile And Fatigue Properties Of Haynes Ā® 233 Manufactured By Wire-Arc Additive Manufacturing, Samuel Onimpa Alfred, Frank W. Liou, Mehdi Amiri
Tensile And Fatigue Properties Of Haynes Ā® 233 Manufactured By Wire-Arc Additive Manufacturing, Samuel Onimpa Alfred, Frank W. Liou, Mehdi Amiri
Mechanical and Aerospace Engineering Faculty Research & Creative Works
HaynesĀ® 233 is a newly developed nickel-based superalloy currently in the early stages of commercial adoption. With the growing interest in fabricating large and complex components using wire-arc additive manufacturing (WAAM), this alloy presents a promising option for industrial applications. This study investigates the microstructure, tensile, and fatigue properties of heat-treated (HT) WAAM Haynes Ā® 233 and compares them to its wrought counterpart. Yield strength (YS), ultimate tensile strength (UTS), and fatigue strength of WAAM Haynes Ā® 233 are 709.4 MPa, 890.1 MPa, and 253.8 MPa, respectively. These values indicate a 63.8 % increase in YS, a 1.11 % decrease ā¦