scholarly journals Influence of three-dimensional nanoparticle branching on the Young’s modulus of nanocomposites: Effect of interface orientation

2015 ◽  
Vol 112 (21) ◽  
pp. 6533-6538 ◽  
Author(s):  
Shilpa N. Raja ◽  
Andrew C. K. Olson ◽  
Aditya Limaye ◽  
Kari Thorkelsson ◽  
Andrew Luong ◽  
...  
Keyword(s):  
Mechanical Properties ◽  
Young’S Modulus ◽  
Young's Modulus ◽  
Three Dimensional ◽  
Elastic Stiffness ◽  
Limited Attention ◽  
Unexpected Finding ◽  
Covalent Bonds ◽  
Lattice Spring Model ◽  
Common Block

With the availability of nanoparticles with controlled size and shape, there has been renewed interest in the mechanical properties of polymer/nanoparticle blends. Despite the large number of theoretical studies, the effect of branching for nanofillers tens of nanometers in size on the elastic stiffness of these composite materials has received limited attention. Here, we examine the Young's modulus of nanocomposites based on a common block copolymer (BCP) blended with linear nanorods and nanoscale tetrapod Quantum Dots (tQDs), in electrospun fibers and thin films. We use a phenomenological lattice spring model (LSM) as a guide in understanding the changes in the Young's modulus of such composites as a function of filler shape. Reasonable agreement is achieved between the LSM and the experimental results for both nanoparticle shapes—with only a few key physical assumptions in both films and fibers—providing insight into the design of new nanocomposites and assisting in the development of a qualitative mechanistic understanding of their properties. The tQDs impart the greatest improvements, enhancing the Young's modulus by a factor of 2.5 at 20 wt.%. This is 1.5 times higher than identical composites containing nanorods. An unexpected finding from the simulations is that both the orientation of the nanoscale filler and the orientation of X-type covalent bonds at the nanoparticle-ligand interface are important for optimizing the mechanical properties of the nanocomposites. The tQD provides an orientational optimization of the interfacial and filler bonds arising from its three-dimensional branched shape unseen before in nanocomposites with inorganic nanofillers.

scholarly journals Effect of Alloying Elements on the Mechanical Properties of Mo3Si

Metals ◽  
2021 ◽  
Vol 11 (1) ◽  
pp. 129
Author(s):  
Wei Bi ◽  
Shunping Sun ◽  
Shaoyi Bei ◽  
Yong Jiang
Keyword(s):  
Mechanical Properties ◽  
Elastic Modulus ◽  
Young’S Modulus ◽  
Young's Modulus ◽  
Poisson Ratio ◽  
Alloying Elements ◽  
Covalent Bonds ◽  
Excellent Thermal Stability ◽  
Nb Doping ◽  
Effect Of Alloying

Molybdenum silicides are attractive high-temperature structural materials because of their excellent thermal stability and outstanding oxidation resistance at high temperatures. First-principles calculations were employed to investigate the effect of alloying elements (Cr, Nb, V, W, Al, Ga, and Ge) on the mechanical properties of Mo3Si. The structural stabilities of doped Mo3Si were calculated, showing that the Pm-3n structure was stable at the investigated low-doping concentration. The calculated elastic constants have also evaluated some essential mechanical properties of doped Mo3Si. Cr- and V-doping decreased the elastic modulus, while Al- and Nb-doping slightly increased the shear and Young’s modulus of Mo3Si. Furthermore, V-, Al- and Nb-doping decreased the B/G and Poisson ratio, suggesting that these elements could form strong covalent bonds, and decrease shear deformation and alloy ductility. Based on the three-dimensional contours and two-dimensional projection of the elastic modulus, Cr- and V-doping exhibited a significant influence on the anisotropy of the shear and Young’s modulus. According to charge density and density of states, the electronic structures of alloyed Mo3Si were further analyzed to reveal the doping effects.

Experimental and multiscale quantum mechanics modeling of the mechanical properties of PVC/graphene nanocomposite

2020 ◽  
Vol 54 (29) ◽  
pp. 4575-4590 ◽  
Author(s):  
Amin Hamed Mashhadzadeh ◽  
Abdolhossein Fereidoon ◽  
Morteza Ghorbanzadeh Ahangari
Keyword(s):  
Electron Microscopy ◽  
Mechanical Properties ◽  
Young’S Modulus ◽  
Young's Modulus ◽  
Van Der Waals ◽  
Dft Method ◽  
Melt Mixing ◽  
Covalent Bonds ◽  
Lennard Jones ◽  
Graphene Nanocomposite

In current work, we developed mechanical properties of PVC (polyvinyl chloride)/graphene nanocomposite theoretically and experimentally. In our theoretical model, a multi-scale finite element model was used to predict Young’s modulus of the stated nanocomposite. The molecular structure of pristine graphene was treated using the density functional theory (DFT) method. By assuming graphene as a space-frame structure that preserves the discrete nature of graphene, they were modeled by the use of three-dimensional elastic beam elements for the Carbon-Carbon covalent bonds and point mass elements for the atoms. Then interfacial van der Waals interaction that exists between PVC and graphene was modeled using the general form of Lennard–Jones potential and simulated by a nonlinear truss rod model. The Lennard–Jones parameters and van der Waals forces were determined versus separation distance for the stated nonlinear truss rod via the DFT method. Finally, we prepared PVC/graphene samples with different weight percentages of graphene nanoplatelets experimentally using the melt-mixing procedure. Our computational modeling demonstrated that the magnitudes of Young’s modulus PVC/graphene were close to the experimentally obtained results until 1 wt% with an average difference of about 25%. Finally, we justified the obtained mechanical results by investigating the morphology of experimental samples using Transmission electron microscopy (TEM) and Scanning Electron Microscopy (SEM) images.

Fluctuation Mechanism of Mechanical Properties of Electroplated-Copper Thin Films Used for Three Dimensional Electronic Modules

2007 ◽  
Vol 353-358 ◽  
pp. 2954-2957 ◽  
Author(s):  
Hideo Miura ◽  
Kazuhiko Sakutani ◽  
Kinji Tamakawa
Keyword(s):  
Thin Films ◽  
Mechanical Properties ◽  
Young’S Modulus ◽  
Young's Modulus ◽  
Bulk Material ◽  
Three Dimensional ◽  
Columnar Structure ◽  
Columnar Grains ◽  
Plane Distribution ◽  
Electroplated Copper

The mechanical properties of copper thin films deposited by sputtering and electroplating were compared using tensile test and nano-indentation. Both the Young’s modulus and tensile strength of the films were found to vary drastically depending on the microstructure of the deposited films. The Young’s modulus of the sputtered film was almost same as that of bulk material. However, the Young’s modulus of the electroplated thin film was about a fourth of that of bulk material. The micro structure of the electroplated film was polycrystalline and a columnar structure with a diameter of a few hundred-micron. The strength of the grain boundaries of the columnar grains seemed to be rather week. In addition, there was a sharp distribution of Young’s modulus along the thickness direction of the film. Though the modulus near the surface of the film was close to that of bulk material, it decreased drastically to about a fourth within the depth of about 1 micron. There was also a plane distribution of Young’s modulus near the surface of the film.

Strain and Stress Distribution in Vickers Indentation of Coated Materials

2006 ◽  
Vol 514-516 ◽  
pp. 1472-1476
Author(s):  
Jorge M. Antunes ◽  
Nataliya A. Sakharova ◽  
José Valdemar Fernandes ◽  
Luís Filipe Menezes
Keyword(s):  
Thin Films ◽  
Mechanical Properties ◽  
Numerical Simulation ◽  
Young’S Modulus ◽  
Indentation Depth ◽  
Young's Modulus ◽  
Three Dimensional ◽  
Depth Sensing ◽  
Coated Materials ◽  
Film Substrate

Depth sensing indentation equipment allows the mechanical properties of thin films to be easily determined, particularly the hardness and Young’s modulus. In order to minimize the influence of the substrate on the measured properties, the indentation depth must be limited to a small fraction of the film’s thickness. However, for very thin films, the determination of the contribution of the substrate and the film to the measured mechanical properties becomes a hard task, because both deform plastically. The numerical simulation of ultramicrohardness tests can be a helpful tool towards better understanding of the influence of the parameters involved in the mechanical characterization of thin films. For this purpose, a three-dimensional numerical simulation home code, HAFILM, was used to simulate ultramicrohardness tests on coated substrates. Materials with different Young’s modulus film/substrate ratios were tested. Analyses of strain and stress distributions for several indentation depth values were performed, in order to clarify the composite behaviour.

Mechanical properties of FeAlSi powders prepared by mechanical alloying from different initial feedstock materials

2019 ◽  
Vol 107 (2) ◽  
pp. 207 ◽  
Author(s):  
Jaroslav Čech ◽  
Petr Haušild ◽  
Miroslav Karlík ◽  
Veronika Kadlecová ◽  
Jiří Čapek ◽  
...  
Keyword(s):  
Mechanical Properties ◽  
Mechanical Alloying ◽  
Young’S Modulus ◽  
Milling Time ◽  
Young's Modulus ◽  
Element Model ◽  
X Ray Diffraction ◽  
X Ray ◽  
Powder Particles ◽  
Complete Homogenization

FeAl20Si20 (wt.%) powders prepared by mechanical alloying from different initial feedstock materials (Fe, Al, Si, FeAl27) were investigated in this study. Scanning electron microscopy, X-ray diffraction and nanoindentation techniques were used to analyze microstructure, phase composition and mechanical properties (hardness and Young’s modulus). Finite element model was developed to account for the decrease in measured values of mechanical properties of powder particles with increasing penetration depth caused by surrounding soft resin used for embedding powder particles. Progressive homogenization of the powders’ microstructure and an increase of hardness and Young’s modulus with milling time were observed and the time for complete homogenization was estimated.

scholarly journals First principles computation of composition dependent elastic constants of omega in titanium alloys: implications on mechanical behavior

2021 ◽  
Vol 11 (1) ◽  
Author(s):  
R. Salloom ◽  
S. A. Mantri ◽  
R. Banerjee ◽  
S. G. Srinivasan
Keyword(s):  
Mechanical Properties ◽  
Young’S Modulus ◽  
First Principles ◽  
Young's Modulus ◽  
Group Vi ◽  
Group V ◽  
Β Phase ◽  
Ti Alloys ◽  
Ω Phase ◽  
Stabilizer Concentration

AbstractFor decades the poor mechanical properties of Ti alloys were attributed to the intrinsic brittleness of the hexagonal ω-phase that has fewer than 5-independent slip systems. We contradict this conventional wisdom by coupling first-principles and cluster expansion calculations with experiments. We show that the elastic properties of the ω-phase can be systematically varied as a function of its composition to enhance both the ductility and strength of the Ti-alloy. Studies with five prototypical β-stabilizer solutes (Nb, Ta, V, Mo, and W) show that increasing β-stabilizer concentration destabilizes the ω-phase, in agreement with experiments. The Young’s modulus of ω-phase also decreased at larger concentration of β-stabilizers. Within the region of ω-phase stability, addition of Nb, Ta, and V (Group-V elements) decreased Young’s modulus more steeply compared to Mo and W (Group-VI elements) additions. The higher values of Young’s modulus of Ti–W and Ti–Mo binaries is related to the stronger stabilization of ω-phase due to the higher number of valence electrons. Density of states (DOS) calculations also revealed a stronger covalent bonding in the ω-phase compared to a metallic bonding in β-phase, and indicate that alloying is a promising route to enhance the ω-phase’s ductility. Overall, the mechanical properties of ω-phase predicted by our calculations agree well with the available experiments. Importantly, our study reveals that ω precipitates are not intrinsically embrittling and detrimental, and that we can create Ti-alloys with both good ductility and strength by tailoring ω precipitates' composition instead of completely eliminating them.

scholarly journals Tailoring a Low Young Modulus for a Beta Titanium Alloy by Combining Severe Plastic Deformation with Solution Treatment

Materials ◽  
2021 ◽  
Vol 14 (13) ◽  
pp. 3467
Author(s):  
Anna Nocivin ◽  
Doina Raducanu ◽  
Bogdan Vasile ◽  
Corneliu Trisca-Rusu ◽  
Elisabeta Mirela Cojocaru ◽  
...  
Keyword(s):  
Electron Microscopy ◽  
Mechanical Properties ◽  
Plastic Deformation ◽  
Severe Plastic Deformation ◽  
Young’S Modulus ◽  
Young's Modulus ◽  
Solution Treatment ◽  
Young Modulus ◽  
Orthopedic Implants ◽  
Beta Titanium Alloy

The present paper analyzed the microstructural characteristics and the mechanical properties of a Ti–Nb–Zr–Fe–O alloy of β-Ti type obtained by combining severe plastic deformation (SPD), for which the total reduction was of etot = 90%, with two variants of super-transus solution treatment (ST). The objective was to obtain a low Young’s modulus with sufficient high strength in purpose to use the alloy as a biomaterial for orthopedic implants. The microstructure analysis was conducted through X-ray diffraction (XRD), scanning electron microscopy (SEM), and high-resolution transmission electron microscopy (HRTEM) investigations. The analyzed mechanical properties reveal promising values for yield strength (YS) and ultimate tensile strength (UTS) of about 770 and 1100 MPa, respectively, with a low value of Young’s modulus of about 48–49 GPa. The conclusion is that satisfactory mechanical properties for this type of alloy can be obtained if considering a proper combination of SPD + ST parameters and a suitable content of β-stabilizing alloying elements, especially the Zr/Nb ratio.

scholarly journals Phase Formation, Microstructure and Mechanical Properties of Mg67Ag33 as Potential Biomaterial

Metals ◽  
2021 ◽  
Vol 11 (3) ◽  
pp. 461
Author(s):  
Konrad Kosiba ◽  
Konda Gokuldoss Prashanth ◽  
Sergio Scudino
Keyword(s):  
Mechanical Properties ◽  
Young’S Modulus ◽  
Young's Modulus ◽  
Equilibrium Phase ◽  
Antibacterial Properties ◽  
Equilibrium Phase Diagram ◽  
Compressive Yield Strength ◽  
X Ray ◽  
Fine Grained ◽  
Equilibrium Phases

The phase and microstructure formation as well as mechanical properties of the rapidly solidified Mg67Ag33 (at. %) alloy were investigated. Owing to kinetic constraints effective during rapid cooling, the formation of equilibrium phases is suppressed. Instead, the microstructure is mainly composed of oversaturated hexagonal closest packed Mg-based dendrites surrounded by a mixture of phases, as probed by X-ray diffraction, electron microscopy and energy dispersive X-ray spectroscopy. A possible non-equilibrium phase diagram is suggested. Mainly because of the fine-grained dendritic and interdendritic microstructure, the material shows appreciable mechanical properties, such as a compressive yield strength and Young’s modulus of 245 ± 5 MPa and 63 ± 2 GPa, respectively. Due to this low Young’s modulus, the Mg67Ag33 alloy has potential for usage as biomaterial and challenges ahead, such as biomechanical compatibility, biodegradability and antibacterial properties are outlined.

scholarly journals Effect of Nanopores on Mechanical Properties of the Shape Memory Alloy

Micromachines ◽  
2021 ◽  
Vol 12 (5) ◽  
pp. 529
Author(s):  
Chunzhi Du ◽  
Zhifan Li ◽  
Bingfei Liu
Keyword(s):  
Mechanical Properties ◽  
Constitutive Model ◽  
Shape Memory ◽  
Young’S Modulus ◽  
Residual Strain ◽  
Surface Effect ◽  
Young's Modulus ◽  
Strain Curve ◽  
Stress Strain ◽  
Strength Limit

Nanoporous Shape Memory Alloys (SMA) are widely used in aerospace, military industry, medical and health and other fields. More and more attention has been paid to its mechanical properties. In particular, when the size of the pores is reduced to the nanometer level, the effect of the surface effect of the nanoporous material on the mechanical properties of the SMA will increase sharply, and the residual strain of the SMA material will change with the nanoporosity. In this work, the expression of Young’s modulus of nanopore SMA considering surface effects is first derived, which is a function of nanoporosity and nanopore size. Based on the obtained Young’s modulus, a constitutive model of nanoporous SMA considering residual strain is established. Then, the stress–strain curve of dense SMA based on the new constitutive model is drawn by numerical method. The results are in good agreement with the simulation results in the published literature. Finally, the stress-strain curves of SMA with different nanoporosities are drawn, and it is concluded that the Young’s modulus and strength limit decrease with the increase of nanoporosity.

Effect of Castor Oil Impregnation on the Physical and Mechanical Properties of Bacterial Cellulose

2012 ◽  
Vol 3 (1) ◽  
pp. 13-26
Author(s):  
Myrtha Karina ◽  
Lucia Indrarti ◽  
Rike Yudianti ◽  
Indriyati
Keyword(s):  
Mechanical Properties ◽  
Tensile Strength ◽  
Bacterial Cellulose ◽  
Young’S Modulus ◽  
Castor Oil ◽  
Young's Modulus ◽  
Physical And Mechanical Properties ◽  
Scanning Electron Micrographs ◽  
Elongation At Break ◽  
Acetone Water

The effect of castor oil on the physical and mechanical properties of bacterial cellulose is described. Bacterial cellulose (BC) was impregnated with 0.5–2% (w/v) castor oil (CO) in acetone–water, providing BCCO films. Scanning electron micrographs revealed that the castor oil penetrated the pores of the bacterial cellulose, resulting in a smoother morphology and enhanced hydrophilicity. Castor oil caused a slight change in crystallinity indices and resulted in reduced tensile strength and Young's modulus but increased elongation at break. A significant reduction in tensile strength and Young's modulus was achieved in BCCO films with 2% castor oil, and there was an improvement in elongation at break and hydrophilicity. Impregnation with castor oil, a biodegradable and safe plasticiser, resulted in less rigid and more ductile composites.

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