Other Materials Science and Engineering Commons^™

Novel And Fast Peridynamic Models For Material Degradation And Failure, Siavash Jafarzadeh

Department of Mechanical and Materials Engineering: Dissertations, Theses, and Student Research

Fracture is one of the main mechanisms of structural failure. Corroded surfaces with chemically-induced damage are, notably, potential sites for crack initiation and propagation in metals, which can lead to catastrophic failure of structures. Despite some progress in simulating fracture and damage using classical models, realistic prediction of complex damage progression and failure has been out of reach for many decades. Peridynamics (PD), a nonlocal theory introduced in 2000, opened up new avenues in modeling material degradation and failure. Existing numerical methods used to discretize PD equations, however, are quite expensive as the PD nonlocal interactions make them unaffordable for …

Exploration Of The Sludge Biodiesel Pathway, Zachary Christman

Department of Agronomy and Horticulture: Dissertations, Theses, and Student Research

Wastewater sludge is an overlooked source of fat, oil, and grease (FOG) that could be converted into biodiesel. The United States produces about 8 million tons of sludge per year. The disposal cost for this amount of sludge is about 2 billion dollars. The widespread availability and low cost of sludge compared to other biodiesel raw materials make it an economical choice for a renewable fuel. Using sludge as a raw material can produce 25 to 30 mg per gram of fatty acid methyl ester (FAME); the main component of biodiesel. Sludge biodiesel has the potential of transforming a portion …

Voltage-Controlled Magnetic Anisotropy In Antiferromagnetic Mgo-Capped Mnpt Films, P. H. Chang, Wuzhang Fang, T. Ozaki, Kirill Belashchenko

Kirill Belashchenko Publications

The magnetic anisotropy in MgO-capped MnPt films and its voltage control are studied using first-principles calculations. Sharp variation of the magnetic anisotropy with film thickness, especially in the Pt-terminated film, suggests that it may be widely tuned by adjusting the film thickness. In thick films the linear voltage control coefficient is as large as 1.5 and -0.6 pJ/Vm for Pt-terminated and Mn-terminated interfaces, respectively. The combination of a widely tunable magnetic anisotropy energy and a large voltage-control coefficient suggest that MgO-capped MnPt films can serve as a versatile platform for magnetic memory and antiferromagnonic applications.

Ultrafast Spin-Currents And Charge Conversion At 3d-5d Interfaces Probed By Time-Domain Terahertz Spectroscopy, T. H. Dang, J. Hawecker, E. Rongione, G. Baez Flores, D. Q. To, J. C. Rojas-Sanchez, H. Nong, J. Mangeney, J. Tignon, F. Godel, S. Collin, P. Seneor, M. Bibes, A. Fert, M. Anane, J. M. George, L. Vila, M. Cosset-Cheneau, D. Dolfi, R. Lebrun, P. Bortolotti, Kirill Belashchenko, S. Dhillon, H. Jaffrès

Kirill Belashchenko Publications

Spintronic structures are extensively investigated for their spin-orbit torque properties, required for magnetic commutation functionalities. Current progress in these materials is dependent on the interface engineering for the optimization of spin transmission. Here, we advance the analysis of ultrafast spin-charge conversion phenomena at ferromagnetic-Transition metal interfaces due to their inverse spin-Hall effect properties. In particular, the intrinsic inverse spin-Hall effect of Pt-based systems and extrinsic inverse spin-Hall effect of Au:W and Au:Ta in NiFe/Au:(W,Ta) bilayers are investigated. The spin-charge conversion is probed by complementary techniques-ultrafast THz time-domain spectroscopy in the dynamic regime for THz pulse emission and ferromagnetic resonance spin-pumping …

Proximity-Induced Magnetization In Graphene: Towards Efficient Spin Gating, Mihovil Bosnar, Ivor Lončarić, P. Lazić, Kirill Belashchenko, Igor Žutić

Kirill Belashchenko Publications

Gate-tunable spin-dependent properties could be induced in graphene at room temperature through the magnetic proximity effect by placing it in contact with a metallic ferromagnet. Because strong chemical bonding with the metallic substrate makes gating ineffective, an intervening passivation layer is needed. Previously considered passivation layers result in a large shift of the Dirac point away from the Fermi level, so that unrealistically large gate fields are required to tune the spin polarization in graphene (Gr). We show that a monolayer of Au or Pt used as the passivation layer between Co and graphene brings the Dirac point closer to …

Detection Of Uncompensated Magnetization At The Interface Of An Epitaxial Antiferromagnetic Insulator, Pavel N. Lapa, Min Han Lee, Igor V. Roshchin, Kirill Belashchenko, Ivan K. Schuller

Kirill Belashchenko Publications

We have probed directly the temperature and magnetic field dependence of pinned uncompensated magnetization at the interface of antiferromagnetic FeF₂ with Cu, using FeF₂-Cu-Co spin valves. Electrons polarized by the Co layer are scattered by the pinned uncompensated moments at the FeF₂-Cu interface giving rise to giant magnetoresistance. We determined the direction and magnitude of the pinned uncompensated magnetization at different magnetic fields and temperatures using the angular dependencies of resistance. The strong FeF₂ anisotropy pins the uncompensated magnetization along the easy axis independent of the cooling field orientation. Most interestingly, magnetic fields as …

Reinvestigation Of The Intrinsic Magnetic Properties Of (Fe1-Xcox)2b Alloys And Crystallization Behavior Of Ribbons, Tej Nath Lamichhane, Olena Palasyuk, Vladimir P. Antropov, Ivan A. Zhuravlev, Kirill Belashchenko, Ikenna C. Nlebedim, Kevin W. Dennis, Anton Jesche, Matthew J. Kramer, Sergey L. Bud'ko, R. William Mccallum, Paul C. Canfield, Valentin Taufour

Kirill Belashchenko Publications

New determination of the magnetic anisotropy from single crystals of (Fe_1-xCo_x)2B alloys are presented. The anomalous temperature dependence of the anisotropy constant is discussed using the standard Callen-Callen theory, which is shown to be insufficient to explain the experimental results. A more material specific study using first-principles calculations with disordered moments approach gives a much more consistent interpretation of the experimental data. Since the intrinsic properties of the alloys with x=0.3-0.35 are promising for permanent magnets applications, initial investigation of the extrinsic properties are described, in particular the crystallization of melt spun ribbons with Cu, Al, …

A Brief Bibliometric Survey On Circularly Polarized Antennas For Mobile Communication, Aniket Gunjal, Abhaya Pal Singh

Library Philosophy and Practice (e-journal)

This paper presents a database review on “Circularly Polarized Antennas for Mobile Communication” as it is the emerging technique used by mobile service provider because of having benefits over other types of antennas available.The polarization purity is now the major issue. In some cases due to cross polarization issue the antenna signal is cancelled at receiver side.So, it is necessary to have circularly polarized antenna to avoid this polarization issue because of change in phase of signal. The change in phase of signal is due to striking of wave on the obstacles and it slightly tilted from its direction causes …

Questaal: A Package Of Electronic Structure Methods Based On The Linear Muffin-Tin Orbital Technique, Dimitar Pashov, Swagata Acharya, Walter R.L. Lambrecht, Jerome Jackson, Kirill Belashchenko, Athanasios Chantis, Francois Jamet, Mark Van Schilfgaarde

Kirill Belashchenko Publications

This paper summarises the theory and functionality behind Questaal, an open-source suite of codes for calculating the electronic structure and related properties of materials from first principles. The formalism of the linearised muffin-tin orbital (LMTO) method is revisited in detail and developed further by the introduction of short-ranged tight-binding basis functions for full-potential calculations. The LMTO method is presented in both Green's function and wave function formulations for bulk and layered systems. The suite's full-potential LMTO code uses a sophisticated basis and augmentation method that allows an efficient and precise solution to the band problem at different levels of theory, …

Effects Of Intrinsic Defects And Alloying With Fe On The Half-Metallicity Of Co2Mnsi, G. G. Baez Flores, Ivan A. Zhuravlev, Kirill Belashchenko

Kirill Belashchenko Publications

The electronic structure and half-metallic gap of Co2MnSi in the presence of crystallographic defects, partial Fe substitution for Mn, and thermal spin fluctuations are studied using the coherent potential approximation and the disordered local moment method. In the presence of 5% Co or Mn vacancies the Fermi level shifts down to the minority-spin valence-band maximum. In contrast to NiMnSb, both types of Mn antisite defects in Co2MnSi are strongly exchange coupled to the host magnetization, and thermal spin fluctuations do not strongly affect the half-metallic gap. Partial substitution of Mn by Fe results in considerable changes in the Bloch spectral …

Proximitized Materials, Igor Žutić, Alex Matos-Abiague, Benedikt Scharf, Hanan Dery, Kirill Belashchenko

Kirill Belashchenko Publications

Advances in scaling down heterostructures and having an improved interface quality together with atomically thin two-dimensional materials suggest a novel approach to systematically design materials. A given material can be transformed through proximity effects whereby it acquires properties of its neighbors, for example, becoming superconducting, magnetic, topologically nontrivial, or with an enhanced spin–orbit coupling. Such proximity effects not only complement the conventional methods of designing materials by doping or functionalization but also can overcome their various limitations. In proximitized materials, it is possible to realize properties that are not present in any constituent region of the considered heterostructure. While the …

Magnetoelectric Memory Cells With Domain-Wall-Mediated Switching, Kirill Belashchenko, Oleg Tchernyshyov, Alexey Kovalev, Dmitri Nikonov

Kirill Belashchenko Publications

A magnetoelectric memory cell with domain - wall - mediated switching is implemented using a split gate architecture . The split gate architecture allows a domain wall to be trapped within a magnetoelectric antiferromagnetic ( MEAF ) active layer . An extension of this architecture applies to multiple gate linear arrays that can offer advantages in memory density , programmability , and logic functionality . Applying a small anisotropic in - plane shear strain to the MEAF can block domain wall precession to improve reliability and speed of switching

Peridynamic Modeling Of Dynamic Fracture In Bio-Inspired Structures For High Velocity Impacts, Sneha Akula

Department of Mechanical and Materials Engineering: Dissertations, Theses, and Student Research

Bio-inspired damage resistant models have distinct patterns like brick-mortar, Voronoi, helicoidal etc., which show exceptional damage mitigation against high-velocity impacts. These unique patterns increase damage resistance (in some cases up to 3000 times more than the constituent materials) by effectively dispersing the stress waves produced by the impact. Ability to mimic these structures on a larger scale can be ground-breaking and could be used in numerous applications. Advancements in 3D printing have now made possible fabrication of these patterns with ease and at a low cost. Research on dynamic fracture in bio-inspired structures is very limited but it is …

Viscoelastic Analysis And Fatigue Characterization Of Bituminous Materials In Two Length Scales Under The Influence Of Aging, Santosh Reddy Kommidi

Department of Civil and Environmental Engineering: Dissertations, Theses, and Student Research

Fatigue cracking in asphalt concrete (AC) is of immense importance to pavement design and analysis because it is one of the most important forms of distress that can lead to structural failure in pavement. Once started, these types of cracks can be combined with other environmental factors leading to detrimental effects such as faster rates of pavement deterioration and shortened pavement life and functionality.

Currently AASHTO TP101, also known as linear amplitude sweep (LAS) specification, is being widely used to evaluate the ability of an asphalt binder to resist fatigue. The LAS method, although mechanistic in its approach, has certain …

Peridynamic Models For Fatigue And Fracture In Isotropic And In Polycrystalline Materials, Guanfeng Zhang

Department of Mechanical and Materials Engineering: Dissertations, Theses, and Student Research

To improve design and reliability, extensive efforts has been devoted to understanding damage and failure of materials and structures using numerical simulation, as a complement of theory and experiment. In this thesis, peridynamics is adopted to study fatigue and dynamic failure problems.

Fatigue is a major failure mode in engineering structures. Predicting fracture/failure under cyclic loading is a challenging problem. Classical model cannot directly be applied to problems with discontinuities. A peridynamic model is adopted in this work because of important advantages of peridynamics in allowing autonomous crack initiation and propagation. A recently proposed peridynamic fatigue crack model is considered …

Fundamental Problems In Porous Materials: Experiments & Computer Simulation, Zhanping Xu

Department of Engineering Mechanics: Dissertations, Theses, and Student Research

Porous materials have attracted massive scientific and technological interest because of their extremely high surface-to-volume ratio, molecular tunability in construction, and surface-based applications. Through my PhD work, porous materials were engineered to meet the design in selective binding, self-healing, and energy damping. For example, crystalline MOFs with pore size spanning from a few angstroms to a couple of nanometers were chemically engineered to show 120 times more efficiency in binding of large molecules. In addition, we found building blocks released from those crystals can be further patched back through a healing process at ambient and low temperatures down to -56 …

Structural, Magnetic And Microstructural Studies Of Composition-Modified Sm-Co Ribbons, Xiujuan Jiang

Department of Mechanical and Materials Engineering: Dissertations, Theses, and Student Research

There is an increasing interest in developing desirable microstructures in hard magnetic materials. Sm-Co-based magnets, bearing superior intrinsic magnetic properties, are good candidates for further development. Two Sm-Co-based alloys, (Sm₁₂Co₈₈)_100-x-yCr_yC_x (taking SmCo₇ phase) and SmCo_4-xFe_xB (a derivative of SmCo₅ phase), were produced using melt-spinning technique. The magnetic properties are correlated to the structural and microstructural properties.

Within the SmCo₇ stoichiometry, cumulative effects of Cr and C additions on the structural and magnetic properties have been investigated. Experimental results have shown that these additions along …

Magnetic Properties Study Of The Mn-Al System With Additions Of B Or C And Mechanical Milling Techniques, Timothy E. Prost

Department of Engineering Mechanics: Dissertations, Theses, and Student Research

Recently a shift in the focus of permanent magnetic research has moved from Rare Earth (RE)-based alloys to those made from more readily available elements. Because of their relatively large magnetocrystalline anisotropy, L1₀ compounds have the potential for use as permanent magnet materials. One particular alloy that is readily available and inexpensive is near equi-atomic manganese and aluminum (Mn₅₀-Al₅₀). First characterized in 1958, it did not receive much attention until more recently when RE supply chain issues made the alloy more attractive for commercial and research applications. The ferromagnetic (FM) τ-phase (L1₀) is …

Computational Microstructure Modeling Of Asphalt Mixtures Subjected To Rate-Dependent Fracture, Francisco Aragao

Department of Civil and Environmental Engineering: Dissertations, Theses, and Student Research

Computational microstructure models have been actively pursued by the pavement mechanics community as a promising and advantageous alternative to limited analytical and semi-empirical modeling approaches. The primary goal of this research is to develop a computational microstructure modeling framework that will eventually allow researchers and practitioners of the pavement mechanics community to evaluate the effects of constituents and mix design characteristics (some of the key factors directly affecting the quality of the pavement structures) on the mechanical responses of asphalt mixtures. To that end, the mixtures are modeled as heterogeneous materials with inelastic mechanical behavior. To account for the complex …

Structural And Magnetic Properties Of Neodymium - Iron - Boron Clusters, Jeremy J. Anderson

Department of Mechanical and Materials Engineering: Dissertations, Theses, and Student Research

Using inert gas condensation techniques the properties of sputtered neodymium-iron-born clusters were investigated. A D.C. magnetron sputtering source created vaporous Nd-Fe-B which was then condensed into clusters and deposited onto silicon substrates. A composite target of Nd-Fe-B discs on an iron plate and a composite target of Nd-(Fe-Co)-B were utilized to create clusters. The clusters were coated with a carbon layer through R.F. sputtering to prevent oxidation.

Samples were investigated in the TEM and showed a size distribution with an average particle diameter of 8.11 nm. The clusters, upon deposition, were amorphous as indicated by diffuse diffraction patterns obtained through …

Anisotropy Of Exchange Stiffness And Its Effect On The Properties Of Magnets, K. D. Belashchenko

Kirill Belashchenko Publications

Using the spin-spiral formulation of the tight-binding linear muffin-tin orbital method, the principal components of the exchange stiffness tensor are calculated for typical hard magnets including tetragonal CoPt-type and hexagonal YCo₅ alloys. The exchange stiffness is strongly anisotropic in all studied alloys. This anisotropy makes the domain wall surface tension anisotropic. Competition between this anisotropic surface tension and magnetostatic energy controls the formation and dynamics of nanoscale domain structures in hard magnets. Anisotropic domain wall bending is described in detail from the general point of view and with application to cellular Sm–Co magnets. It is shown that the repulsive …