Modeling thermodynamic properties of Ni, Sn, Al and Cu nanosolids
نویسندگان
چکیده
Surface atoms and dangling bonds on the surface affect thermodynamic properties. A thermodynamical model, based cohesive energy is presented to discuss melting properties of materials at nanoscale. The model used realize effect size shape temperature Tmn, entropy Smn enthalpy Hmn Ni, Sn, Al Cu metallic nanoparticles. variation in are examined for nanowire, film, spherical, regular tetrahedral, hexahedral octahedral shaped It reported that decrease with decreasing nanoparticles smaller particle size, greater effects when less than 10 nm, it has been predicted reduce appreciably. Also, same more departs from sphere, its changes nanowire tetrahedral shape. Our theoretical results compared available experimental or simulation data. Results by our good agreement observations.
منابع مشابه
CALCULATION OF THERMODYNAMIC PROPERTIES OF Al-Fe, Al-Ni AND Ni-Fe ALLOYS USING FACTSAGE
Thermodynamic predicting analysis of three binary systems Al-Fe, Al-Ni and Ni-Fe are shown in this paper. Thermodynamic analysis involved calculation of activities, coefficient of activities, partial and integral values for enthalpies and Gibbs energies of mixing and excess energies at three different temperatures: 1873K, 1900K and 1973K, as well as calculated phase diagrams, for the investigat...
متن کاملReactions in Electrodeposited Cu/Sn and Cu/Ni/Sn Nanoscale Multilayers for Interconnects
Miniaturization of electronic devices has led to the development of 3D IC packages which require ultra-small-scale interconnections. Such small interconnects can be completely converted into Cu-Sn based intermetallic compounds (IMCs) after reflow. In an effort to improve IMC based interconnects, an attempt is made to add Ni to Cu-Sn-based IMCs. Multilayer interconnects consisting of stacks of C...
متن کاملExperimental study and thermodynamic modeling of the Al–Co–Cr–Ni system
A thermodynamic database for the Al-Co-Cr-Ni system is built via the Calphad method by extrapolating re-assessed ternary subsystems. A minimum number of quaternary parameters are included, which are optimized using experimental phase equilibrium data obtained by electron probe micro-analysis and x-ray diffraction analysis of NiCoCrAlY alloys spanning a wide compositional range, after annealing ...
متن کاملThermodynamic properties of Al, Ni, NiAl, and Ni3Al from first-principles calculations
The thermodynamic properties of Al, Ni, NiAl, and Ni3Al were studied using the first-principles approach. The 0-K total energies are calculated using the ab initio plane wave pseudopotential method within the generalized gradient approximation. The contribution to the free energy from the lattice vibration was calculated using the phonon densities of states derived by means of the ab initio lin...
متن کاملOptical properties of Ni and Cu nanowire arrays and Ni/Cu superlattice nanowire arrays
: In this study, Ni and Cu nanowire arrays and Ni/Cu superlattice nanowire arrays are fabricated using standard techniques such as electrochemical deposition of metals into porous anodic alumina oxide templates having pore diameters of about 50 nm. We perform optical measurements on these nanowire array structures. Optical reflectance (OR) of the as-prepared samples is recorded using an imaging...
متن کاملذخیره در منابع من
با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید
ژورنال
عنوان ژورنال: High Temperatures-high Pressures
سال: 2022
ISSN: ['0018-1544', '1472-3441']
DOI: https://doi.org/10.32908/hthp.v51.1263