Search Results - "FACE centered cubic structure"

Exact lattice summations for Lennard-Jones potentials coupled to a three-body Axilrod–Teller–Muto term applied to cuboidal phase transitions.

Authors: Robles-Navarro, Andres Cooper, Shaun Buchheit, Andreas A. et al.

Source: Journal of Chemical Physics. 9/7/2025, Vol. 163 Issue 9, p1-35. 35p.

Subject Terms: *FACE centered cubic structure, *BODY centered cubic structure, *CONDENSED matter physics, *CRYSTAL structure, *CRYSTALLOGRAPHY

Metastable states assisted homogeneous nucleation in supercooled liquid aluminum alloys: Insights from a phenomenologically coupled atomistic, phase-field, and machine learning investigation.

Authors: Hasan, Md Mahmudul Choudhuri, Deep

Source: Journal of Chemical Physics. 2/28/2025, Vol. 162 Issue 8, p1-23. 23p.

Subject Terms: *SUPERCOOLED liquids, *FACE centered cubic structure, *HOMOGENEOUS nucleation, *LIQUID aluminum, *LIQUID alloys

The Gibbs method extended to nanothermodynamics and exemplified by evaluations of the surface, line, and point excess energies for icosahedral metal nanoclusters.

Authors: Samsonov, V. M. Vasilyev, S. A. Talyzin, I. V. et al.

Source: Journal of Chemical Physics. 2/21/2025, Vol. 162 Issue 7, p1-13. 13p.

Subject Terms: *FACE centered cubic structure, *MOLECULAR dynamics, *SURFACE energy, *BULK solids, *COPPER

Deformation and reverse phase transformation mechanism of high-pressure HCP iron during unloading process.

Authors: Yu, Jinmin Shao, Jianli Shu, Hua et al.

Source: Journal of Applied Physics. 1/28/2025, Vol. 137 Issue 4, p1-18. 18p.

Subject Terms: *FACE centered cubic structure, *SHEARING force, *CRYSTAL grain boundaries, *PHASE transitions, *SINGLE crystals

The theory of Barlow packings: Basic properties and cohesive energies from exact lattice summations within the sticky hard-sphere model.

Authors: Cooper, Shaun Robles-Navarro, Andres Smits, Odile R. et al.

Source: Journal of Chemical Physics. 1/7/2025, Vol. 162 Issue 1, p1-22. 22p.

Subject Terms: *FACE centered cubic structure, *SPHERE packings, *LATTICE theory, *BESSEL functions, *INVERSE functions

Ab initio study of randomly disordered hexagonal close-packed (rhcp) phase in platinum.

Authors: Burakovsky, L. Preston, D. L. Errandonea, D.

Source: Journal of Applied Physics. 1/7/2025, Vol. 137 Issue 1, p1-16. 16p.

Subject Terms: *PHASE transitions, *FACE centered cubic structure, *EQUATIONS of state, *QUANTUM theory, *PHASE diagrams

Search for promising structures and superconductivity in high-pressure Sr through first-principles calculations.

Authors: Geshi, Masaaki Funashima, Hiroki Hettiarachchi, Gayan Prasad

Source: Journal of Applied Physics. 11/28/2024, Vol. 136 Issue 20, p1-8. 8p.

Subject Terms: *FACE centered cubic structure, *PHASE transitions, *SUPERCONDUCTIVITY

Brownian dynamics simulation of the structural evolution in monodisperse hard-sphere suspensions during drying and sedimentation processes.

Authors: Kim, Yeji Lee, Young Ki

Source: Journal of Chemical Physics. 11/14/2024, Vol. 161 Issue 18, p1-14. 14p.

Subject Terms: *FACE centered cubic structure, *NEWTONIAN fluids, *STRUCTURAL dynamics, *COLLOIDS, *DIMENSIONLESS numbers

Biogenic synthesis of Adiantum latifolium-coated silver nanoparticles: biophysical characterization, antimicrobial efficacy, larvicidal activity and biotoxicity assessment.

Authors: R, Lekshmi Nayar, Adhira M. Kumar R, Pradeep et al.

Source: Bioscience Nanotechnology. 10/6/2025, Vol. 1 Issue 1, p1-16. 16p.

Subject Terms: *FOURIER transform infrared spectroscopy, *FACE centered cubic structure, *AEDES aegypti, *MOSQUITO-borne diseases, *AEDES albopictus

Galois trace forms of type An,Dn,En for odd n.

Authors: Higa, Riku Hirakawa, Yoshinosuke

Source: Journal of Number Theory. Oct2025, Vol. 275, p196-213. 18p.

Subject Terms: *FACE centered cubic structure, *ODD numbers, *PRIME numbers, *QUADRATIC fields, *PRIME ideals, *CYCLIC codes

Structural and antibacterial properties of Ag/GO wound dressing.

Authors: Alamdari, Sanaz Noori, Morteza Rezaei, Fatemeh et al.

Source: Nanomedicine Journal. Autumn2025, Vol. 12 Issue 4, p789-796. 8p.

Subject Terms: *FACE centered cubic structure, *X-ray diffraction, *SILVER nanoparticles, *BACTERIAL colonies, *INFECTION control

A quantitative theory and atomistic simulation study on the soft-sphere crystal-melt interfacial properties. II. Interfacial free energies.

Authors: Wang, Ya-Shen Liang, Zun Laird, Brian B. et al.

Source: Journal of Chemical Physics; 9/7/2025, Vol. 163 Issue 9, p1-11, 11p

Subject Terms: DENSITY wave theory, BODY centered cubic structure, FACE centered cubic structure, MOLECULAR dynamics, FREE energy (Thermodynamics)

Cryogenic temperatures promote the pressure-induced polymorphic transition in CoCrFeMnNi high entropy alloy.

Authors: Hörnqvist Colliander, Magnus Haase, Dörthe Glazyrin, Konstantin et al.

Source: Journal of Applied Physics. 9/21/2024, Vol. 136 Issue 11, p1-10. 10p.

Subject Terms: *HIGH-entropy alloys, *FACE centered cubic structure, *TRANSITION temperature, *AB-initio calculations, *HIGH temperatures, *POLYMORPHISM (Crystallography)

Stability mechanism of crystalline CO2 and Xe.

Authors: Tanaka, Hideki Matsumoto, Masakazu Yagasaki, Takuma et al.

Source: Journal of Chemical Physics. 8/28/2024, Vol. 161 Issue 8, p1-9. 9p.

Subject Terms: *FACE centered cubic structure, *MOLECULAR dynamics, *SURFACE potential, *EQUATIONS of state, *CRYSTALS

Versatile stochastic model for predictive KMC simulation of fcc metal nanostructure evolution with realistic kinetics.

Authors: Han, Yong Evans, James W.

Source: Journal of Chemical Physics. 8/21/2024, Vol. 161 Issue 7, p1-11. 11p.

Subject Terms: *FACE centered cubic structure, *MONTE Carlo method, *THIN films, *STOCHASTIC models, *SURFACE analysis

Characterization of the microstructural, magnetic, and thermal behaviors of boron-doped Fe–Co–Ni alloys produced via mechanical alloying.

Authors: Khitouni, Nawel Daly, Rakia Daza, Jason et al.

Source: Journal of Applied Physics. 7/21/2024, Vol. 136 Issue 3, p1-10. 10p.

Subject Terms: *MECHANICAL alloying, *FACE centered cubic structure, *DOPING agents (Chemistry), *ALLOYS, *AMORPHOUS alloys, *RECRYSTALLIZATION (Metallurgy)

Effect of the deformation temperature and strain on the strain rate sensitivity of fcc medium-entropy alloys.

Authors: Mahato, Swati Jha, Saumya R. Sonkusare, Reshma et al.

Source: Journal of Applied Physics. 7/14/2024, Vol. 136 Issue 2, p1-14. 14p.

Subject Terms: *STRAINS & stresses (Mechanics), *FACE centered cubic structure, *SHEAR (Mechanics), *TEMPERATURE effect, *DISLOCATION structure, *STRAIN rate, *GRAIN size

A simple and accurate method to determine fluid–crystal phase boundaries from direct coexistence simulations.

Authors: Smallenburg, Frank Del Monte, Giovanni de Jager, Marjolein et al.

Source: Journal of Chemical Physics. 6/14/2024, Vol. 160 Issue 22, p1-12. 12p.

Subject Terms: *FACE centered cubic structure, *COULOMB potential, *SPHERES, *CRYSTALS

High-temperature tensile behavior and constitutive model in Co-free Fe40Mn20Cr20Ni20 high-entropy alloy.

Authors: Li, Fan Han, Lina Wang, Xuejiao et al.

Source: Journal of Applied Physics. 5/28/2024, Vol. 135 Issue 20, p1-13. 13p.

Subject Terms: *ARTIFICIAL neural networks, *FACE centered cubic structure, *HEAT treatment, *IRON-manganese alloys, *STRAIN rate, *DISPERSION strengthening

Growth of Ni1-xCuxO nanoparticles through flash combustion route and their improved photocatalytic properties for wastewater treatment.

Authors: Khan, Ziaul Raza Kumar, Ashwani Mohamed, Mansour et al.

Source: Ceramics International. Sep2025:Part B, Vol. 51 Issue 21, p34223-34233. 11p.

Subject Terms: *FACE centered cubic structure, *FIELD emission electron microscopes, *TRANSMISSION electron microscopes, *COPPER, *METAL nanoparticles, *CHARGE carriers