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First-Principles Simulations Of Materials Under Extreme Conditions, Kien Nguyen Cong 2019 University of South Florida

First-Principles Simulations Of Materials Under Extreme Conditions, Kien Nguyen Cong

USF Tampa Graduate Theses and Dissertations

The investigation of materials at extreme conditions of high pressure and temperature (high-PT), has been one of the greatest scientific endeavors in condensed mater physics, chemistry, astronomy, planetary, and material sciences. Being subjected to high-PT conditions, materials exhibit dramatic changes in both atomic and electronic structure resulting in an emergence of exceptionally interesting phenomena including structural and electronic phase transitions, chemical reactions, and formation of novel compounds with never-previously observed physical and chemical properties. Although new exciting experimental developments in static and dynamic compression combined with new diagnostics/characterization methods allow to uncover new processes and phenomena at high P-T conditions, …


Sorbents For Cleaning Of Vegetable Oils, Ikromov Oybek, Suvanova Fayoza, Farmonov Jasur 2019 Karshi Engineering Economic Institute, Uzbekistan

Sorbents For Cleaning Of Vegetable Oils, Ikromov Oybek, Suvanova Fayoza, Farmonov Jasur

CHEMISTRY AND CHEMICAL ENGINEERING

The article presents the results of the study of adsorbents obtained from rice husk. To increase the sorption capacity of the raw material is treated with hydrogen peroxide for 30 minutes and subjected to roasting. Before thermal activation, the resulting mass was treated with a 30% alumium calcium alum solution. Reagent consumption is 20% of the mass of the adsorbent. The alum-enriched adsorbent is thermally activated at a temperature of 300-800 °C without oxygen access for two hours. According to the results of laboratory tests, the adsorbents that have undergone thermal activation at a temperature of 500-800 °C have the …


Development Of Environmentally Friendly Drilling Fluids In Order To Reduce The Anthropogenic Impact On The Environment, Arslanova Nodirakhon, Arslanov Sharafutdin, Zavorotnyy Vitaliy Leonidovich 2019 JSC Institute of geology and exploration of oil and gas fields, Tashkent, Uzbekistan

Development Of Environmentally Friendly Drilling Fluids In Order To Reduce The Anthropogenic Impact On The Environment, Arslanova Nodirakhon, Arslanov Sharafutdin, Zavorotnyy Vitaliy Leonidovich

CHEMISTRY AND CHEMICAL ENGINEERING

The article discusses natural clay as a raw material for drilling fluids of the oil and gas industry of the Republic of Uzbekistan. Studied compositions of clays from the Akoy and Navbakhor area (the Republic of Uzbekistan) and Tagansky area (Republic of Kazakhstan) were. Evaluated technological parameters of clay powders based on the original and modified explored clays. Were determined modifying additives (2.0% Na2CO3 and PAA 0.25%) to obtain low-toxic clay powders that do not have a technogenic impact on the environment during the drilling process. Calculations are confirmed by the results of bio-testing using standard methods based on the …


Physico-Chemical Properties Of Hydrogel Based On 1-Chloro-3-Piperidino-2-Propylacrylate, Pulatova Nilufar, Maksumova Oytura 2019 Tashkent Chemical-Technological Institute, Uzbekistan

Physico-Chemical Properties Of Hydrogel Based On 1-Chloro-3-Piperidino-2-Propylacrylate, Pulatova Nilufar, Maksumova Oytura

CHEMISTRY AND CHEMICAL ENGINEERING

In the article the results of synthesis of the reticulated high molecular connection are rotined on the basis of 1-khlor-3-piperidin-2-propilakrilata, his structure and properties. Influence of different factors is studied on the process of receipt of hydrogel. Physical and chemical properties of polymer are studied on the basis of 1-khlor-3-piperidin-2-propilakrilata, swelling speed in water and different environments. A change speed of swelling of hydrogel is rotined from acid and alkaline terms, that them it is possible to vary. A change swelling speed depending on a temperature was studied at different temperatures and it is rotined that with the increase of …


Micro-Mechanical Analysis Of Corrosion Products Formed During Long-Term Carbonation Induced Corrosion Of Steel, Marijana Serdar, Dubravka Bjegovic, Valérie L’Hostis, Stéphane Poyet, Damien Féron 2019 Faculty of Civil Engineering, University of Zagreb

Micro-Mechanical Analysis Of Corrosion Products Formed During Long-Term Carbonation Induced Corrosion Of Steel, Marijana Serdar, Dubravka Bjegovic, Valérie L’Hostis, Stéphane Poyet, Damien Féron

International Conference on Durability of Concrete Structures

During corrosion distinct types of corrosion products form, composed of different ratios of ferrous ions and oxide, hydroxides. Corrosion products have different physical and mechanical properties, mainly density, resistivity, volume and modulus of elasticity compared to iron. Knowing properties of corrosion products is indispensable for service life modelling of structures and can give valuable insight into the long-term corrosion propagation process. In this study micro-indentation method was used to evaluate mechanical properties of different layers formed during long-term carbonation induced corrosion of steel in concrete. Investigation was performed on three sets of reinforced concrete samples, that underwent corrosion during 50, …


Development Of Engineered Cementitious Composites With Conductive Inclusions For Use In Self-Sensing Applications, Benny Suryanto Dr, Danah Saraireh Ms, Steven Walls Mr, Jaehwan Kim Dr, W John McCarter Prof 2019 Heriot-Watt University

Development Of Engineered Cementitious Composites With Conductive Inclusions For Use In Self-Sensing Applications, Benny Suryanto Dr, Danah Saraireh Ms, Steven Walls Mr, Jaehwan Kim Dr, W John Mccarter Prof

International Conference on Durability of Concrete Structures

The mechanical and a.c. electrical properties of a new varietal of engineered cementitious composite (ECC) incorporating conductive inclusions are presented. Electrical measurements were undertaken over a wide frequency range while curing and when under uniaxial tensile loading to study the influence of ongoing hydration and multiple microcrack formation on the composite electrical impedance. When presented in Nyquist format, the work shows that conductive inclusions reduce the bulk resistance of the composite while enhancing its polarizability, transforming the classic, single-arc bulk response of typical cement-based materials to a two-arc response. The bulk resistance was shown to increase with time and damage, …


Why The Crackling Deformations Of Single Crystals, Metallic Glasses, Rock, Granular Materials, And The Earth’S Crust Are So Surprisingly Similar, Karin A. Dahmen, Jonathan T. Uhl, Wendelin J. Wright 2019 University of Illinois at Urbana-Champaign

Why The Crackling Deformations Of Single Crystals, Metallic Glasses, Rock, Granular Materials, And The Earth’S Crust Are So Surprisingly Similar, Karin A. Dahmen, Jonathan T. Uhl, Wendelin J. Wright

Faculty Journal Articles

Recent experiments show that the deformation properties of a wide range of solid materials are surprisingly similar. When slowly pushed, they deform via intermittent slips, similar to earthquakes. The statistics of these slips agree across vastly different structures and scales. A simple analytical model explains why this is the case. The model also predicts which statistical quantities are independent of the microscopic details (i.e., they are "universal"), and which ones are not. The model provides physical intuition for the deformation mechanism and new ways to organize experimental data. It also shows how to transfer results from one scale to another. …


Combined Molecular Dynamics And Phase Field Simulation Of Crystal Melt Interfacial Properties And Microstructure Evolution During Rapid Solidification Of Ti-Ni Alloys, Sepideh Kavousi 2019 Louisiana State University and Agricultural and Mechanical College

Combined Molecular Dynamics And Phase Field Simulation Of Crystal Melt Interfacial Properties And Microstructure Evolution During Rapid Solidification Of Ti-Ni Alloys, Sepideh Kavousi

LSU Doctoral Dissertations

Phase field method has become a popular tool to investigate the microstructure evolution during the solidification. Quantitative predictions using this method is still limited, and in this dissertation, we try to study this problem from different perspectives.

Most of the phase field models consider the solid-liquid interface to be in local equilibrium. Solidification during some manufacturing processes like selective laser melting, and electron beam additive manufacturing is rapid and far from equilibrium which can result in supersaturated solid solutions, segregation-free crystals, or metastable phases. Before obtaining any conclusions from the phase field simulations, we must know the answer for “which …


Mechanical And Microstructure Characteristics Of Concrete-Mixtures Designed For Durability Of Rc-Structures In Corrosive Environment, SAEID A. ALGHAMDI Dr., S. Ahmad, M. M. Khaled 2019 King Fahd Univ. of Petroleum & Minerals

Mechanical And Microstructure Characteristics Of Concrete-Mixtures Designed For Durability Of Rc-Structures In Corrosive Environment, Saeid A. Alghamdi Dr., S. Ahmad, M. M. Khaled

International Conference on Durability of Concrete Structures

As exposures to chloride-salts are known as prime factors causing initiation and continuity of corrosion-process of steel reinforcement bars in reinforced concrete (RC) structures, it has always been a major concern for designers considering the requirements of structural-durability for targeted-service life of RC-structures in aggressively corrosive environments typically prevalent in coastal regions. Research works previously reported by the researchers have modeled corrosion-process in terms of corrosion-current density, and it was realized that concrete-mixtures design quality and characteristics, degree of exposures to corrosive-agents such as chloride salts, and protective-concrete cover-thickness are now known beyond doubt to be determinant factors as regards …


Experimental And Numerical Investigation On The Irregularity Of Carbonation Depth Of Concrete Under Supercritical Condition, Hao Bao Masc, Min Yu Dr., Jianqiao Ye Dr., Lihua Xu Dr., Yin Chi Dr., J Ye 2019 Wuhan University

Experimental And Numerical Investigation On The Irregularity Of Carbonation Depth Of Concrete Under Supercritical Condition, Hao Bao Masc, Min Yu Dr., Jianqiao Ye Dr., Lihua Xu Dr., Yin Chi Dr., J Ye

International Conference on Durability of Concrete Structures

The heterogeneity of a cement-based material results in a random spatial distribution of carbonation depth, which may significantly affect the mechanical properties and durability of the material. Currently, there is a lack of both experimental and numerical investigations aiming at a statistical understanding of this important phenomenon. This paper presents both experimental and numerical supercritical carbonation test results of concrete blocks. The random fields of porosity and two-dimension random aggregate model of concrete were proposed for the simulation. The carbonation depths are measured and distributed along the carbonation boundary by the proposed rapid image processing technique, which are then statistically …


Guiding Principles In Developing The South African Approach To Durability Index Testing Of Concrete, Yunus Ballim, Mark Alexander 2019 School of Civil & Environmental Engineering, University of the Witwatersrand, Johannesburg, South Africa

Guiding Principles In Developing The South African Approach To Durability Index Testing Of Concrete, Yunus Ballim, Mark Alexander

International Conference on Durability of Concrete Structures

Focused thinking on the possibility of early-age testing of concrete for long-term durability started in earnest during the late 1980’s in South Africa. Through sustained research, development and trial implementation on construction projects, three durability index (DI) tests have emerged, two of which have been adopted as national standard test methods for concrete construction, the remaining one being prepared a national standard. In this paper we review the guiding or foundational principles that directed the development of these DI tests, with a view to assessing the appropriateness and relevance of these guiding principles to modern concretes. The last 30 years …


The Effect Of Calcium Nitrate On The Hydration Of Calcium Aluminate Cement At Different Curing Temperatures, Hongxia Wang, Guizhi Diao, Guanghua Liu, H Wang, Lixiong Gao, Guangwei Liu 2019 China Building Materials Academy,State Key Laboratory of Green Building Materials

The Effect Of Calcium Nitrate On The Hydration Of Calcium Aluminate Cement At Different Curing Temperatures, Hongxia Wang, Guizhi Diao, Guanghua Liu, H Wang, Lixiong Gao, Guangwei Liu

International Conference on Durability of Concrete Structures

Phase conversion in calcium aluminate cements (CAC) induces significant volumetric instability; it would result in an increase in porosity and decrease in strength in CAC. In this study, calcium nitrate (CN) as a phase conversion inhibitor, the effect of CN on the hydration of CAC at different curing temperatures was studied. Xray diffraction, thermal analysis, SEM, isothermal calorimetry and the compressive strength were conducted on the CAC dosages of 0%, 5%, 10% and 15%CN cured at 20�, 30�, 40� and 50�. The results show CN can retard CAC hydration, alter the characters of the hydrates of CAC systems and avoid …


The Influence Of Waste Glass Powder On The Chloride Binding Capacity Of Fly Ash/Cement Hardened Paste, JH Yan, Tingyu Hao 2019 Purdue University

The Influence Of Waste Glass Powder On The Chloride Binding Capacity Of Fly Ash/Cement Hardened Paste, Jh Yan, Tingyu Hao

International Conference on Durability of Concrete Structures

The potential of using waste glass powder to increase the chloride binding capacity of fly ash/cement hardened paste was investigated. When only fly ash replacing cement, the chloride binding capacity was raised within 28d when the fly ash replacement level was in the range from 30-50% by mass. But at a longer age of 60 to 90d, the binding performance was increased at the replacement level of 10-30wt%. The chloride binding capacity of glass powder-fly ash-cement system was increased by adding glass powder of 2% and 4% by mass at 7d while those at larger addition and longer age reduced. …


Alkali Reactive Carbonate Rocks: Is It Alkali Silica Reaction (Asr) Or Alkali Carbonate Reaction (Acr)?, Mengesha Beyene, RC Meininger 2019 SES Group & Associates, LLC

Alkali Reactive Carbonate Rocks: Is It Alkali Silica Reaction (Asr) Or Alkali Carbonate Reaction (Acr)?, Mengesha Beyene, Rc Meininger

International Conference on Durability of Concrete Structures

The root cause of distress in two different concrete structures made from carbonate coarse aggregates that fit the textural and compositional criteria cited for ACR was found to be caused by ASR, not ACR. Stereo-optical examination and transmitted polarized light microscopy (PLM) analysis showed that the concretes contain some dark gray, fine-grained argillaceous dolomitic coarse aggregates in which secondary white deposit filling the cracks extending from these aggregates into the paste (as well as lining air voids) is ASR gel. Back scattered electron (BSE) imaging with EDS spectra and x-ray elemental mappings, clearly confirm that the white secondary deposits consist …


An Investigation Of High-Speed Consolidation And Repair Of Carbon Fiber - Epoxy Composites Through Ultrasonic Welding, David A. Hoskins 2019 Louisiana State University and Agricultural and Mechanical College

An Investigation Of High-Speed Consolidation And Repair Of Carbon Fiber - Epoxy Composites Through Ultrasonic Welding, David A. Hoskins

LSU Master's Theses

Adhesive repair of carbon fiber composite structures is commonly done on damaged structures to extend the service life. This method requires careful preparation of the damaged surface with intricate steps to ensure good bonding between the repair patch and the parent structure by means of an adhesive film. As with many forms of composite manufacturing, it is required to perform vacuum bagging, debulking, and a heated cure depending on the resin. All these steps make the repair process costly and time consuming.

In this present work, an alternative method of repair is investigated which explores the experimental feasibility of using …


Grain Refinement In Iron-Based Materials, Simon Naumovich Lekakh, Von Richards, Ronald J. O'Malley, Jun Ge 2019 Missouri University of Science and Technology

Grain Refinement In Iron-Based Materials, Simon Naumovich Lekakh, Von Richards, Ronald J. O'Malley, Jun Ge

Materials Science and Engineering Faculty Research & Creative Works

A process for manufacturing an iron-based alloy comprising forming targeted fine oxide and/or carbide dispersoids in a melt, and sequentially precipitating transition-metal nitrides on the dispersoids for heterogeneous nucleation of equiaxed grains. An iron-based cast alloy having a highly equiaxed fine grain structure.


A Parametric Study For In-Pile Use Of The Thermal Conductivity Needle Probe Using A Transient, Multilayered Analytical Model, Courtney Hollar, Austin Fleming, Kurt Davis, Ralph Budwig, Colby Jensen, David Estrada 2019 University of Idaho

A Parametric Study For In-Pile Use Of The Thermal Conductivity Needle Probe Using A Transient, Multilayered Analytical Model, Courtney Hollar, Austin Fleming, Kurt Davis, Ralph Budwig, Colby Jensen, David Estrada

Materials Science and Engineering Faculty Publications and Presentations

By utilizing an in-pile measurement, thermal conductivity can be determined under prototypic conditions over a range of burnup. In this work we develop a multilayer quadrupoles analytical model to describe the transient thermal interactions between a line heat source (i.e. needle probe) and cylindrical nuclear fuel geometry for inpile thermal conductivity measurements. A finite element analysis of the detailed needle probe geometry was compared to results from the analytical model to verify the assumptions made in the analytical model. Experimentally, the needle probe was used to measure the thermal properties of polytetrafluoroethylene (PTFE) and stainless steel 304 with three different …


Utilizing A Single Silica Nanospring As An Insulating Support To Characterize The Electrical Transport And Morphology Of Nanocrystalline Graphite, David Estrada, Paul H. Davis, Twinkle Pandhi 2019 Boise State University

Utilizing A Single Silica Nanospring As An Insulating Support To Characterize The Electrical Transport And Morphology Of Nanocrystalline Graphite, David Estrada, Paul H. Davis, Twinkle Pandhi

Materials Science and Engineering Faculty Publications and Presentations

A graphitic carbon, referred to as graphite from the University of Idaho thermolyzed asphalt reaction (GUITAR), was coated in silica nanosprings and silicon substrates via the pyrolysis of commercial roofing tar at 800 °C in an inert atmosphere. Scanning electron microscopy and transmission electron microscopy images indicate that GUITAR is an agglomeration of carbon nanospheres formed by the accretion of graphitic flakes into a ~100 nm layer. Raman spectroscopic analyses, in conjunction with scanning electron microscopy and transmission electron microscopy, indicate that GUITAR has a nanocrystalline structure consisting of ~1–5 nm graphitic flakes interconnected by amorphous sp3 bonded carbon. …


Contamination Of Coupling Glass And Performance Evaluation Of Protective System In Vacuum Laser Beam Welding, Yongki Lee, Jason Cheon, Byung-Kwon Min, Cheolhee Kim 2019 Korea Institute of Industrial Technology

Contamination Of Coupling Glass And Performance Evaluation Of Protective System In Vacuum Laser Beam Welding, Yongki Lee, Jason Cheon, Byung-Kwon Min, Cheolhee Kim

Mechanical and Materials Engineering Faculty Publications and Presentations

Vacuum laser beam welding enables deeper penetration depth and welding stability than atmospheric pressure laser welding. However, contaminated coupling glass caused by welding fumes in the vacuum space reduces laser transmittance, leading to inconsistent penetration depth. Therefore, a well-designed protective system is indispensable. Before designing the protective system, the contamination phenomenon was quantified and represented by a contamination index, based on the coupling glass transmittance. The contamination index and penetration depth behavior were determined to be inversely proportional. A cylindrical protective system with a shielding gas supply was proposed and tested. The shielding gas jet provides pressure-driven contaminant suppression and …


Inas(111)A Homoepitaxy With Molecular Beam Epitaxy, Kevin D. Vallejo, Trent A. Garrett, Kathryn E. Sautter, Kevin Saythavy, Baolai Liang, Paul J. Simmonds 2019 Boise State University

Inas(111)A Homoepitaxy With Molecular Beam Epitaxy, Kevin D. Vallejo, Trent A. Garrett, Kathryn E. Sautter, Kevin Saythavy, Baolai Liang, Paul J. Simmonds

Materials Science and Engineering Faculty Publications and Presentations

The authors have established a robust set of growth conditions for homoepitaxy of high-quality InAs with a (111)A crystallographic orientation by molecular beam epitaxy (MBE). By tuning the substrate temperature, the authors obtain a transition from a 2D island growth mode to step-flow growth. Optimized MBE parameters (substrate temperature = 500 °C, growth rate = 0.12ML/s, and V/III ratio ≥ 40) lead to the growth of extremely smooth InAs(111)A films, free from hillocks and other 3D surface imperfections. The authors see a correlation between InAs surface smoothness and optical quality, as measured by photoluminescence spectroscopy. This work establishes InAs(111)A as …


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