Statistical Thermodynamics of General Minimal Diffusion Processes: Constuction, Invariant Density, Reversibility and Entropy Production

The solution to nonlinear Fokker-Planck equation is constructed in terms of the minimal Markov semigroup generated by the equation. The semigroup is obtained by a purely functional analytical method via Hille-Yosida theorem. The existence of the positive invariant measure with density is established and a weak form of Foguel alternative proven. We show the equivalence among self-adjoint of the elliptic operator, time-reversibility, and zero entropy production rate of the stationary diffusion process. A thermodynamic theory for diffusion processes emerges.Comment: 23 page

Three-dimensional topological insulators in the octahedron-decorated cubic lattice

We investigate a tight-binding model of the octahedron-decorated cubic lattice with spin-orbit coupling. We calculate the band structure of the lattice and evaluate the Z_2 topological indices. According to the Z_2 topological indices and the band structure, we present the phase diagrams of the lattice with different filling fractions. We find that the $(1;111)$ and $(1;000)$ strong topological insulators occur in some range of parameters at 1/6, 1/2 and 2/3 filling fractions. Additionally, the $(0;111)$ weak topological insulator is found at 1/6 and 2/3 filing fractions. We analyze and discuss the characteristics of these topological insulators and their surfaces states

Multiscale examination of strain effects in Nd-Fe-B permanent magnets

We have performed a combined first-principles and micromagnetic study on the strain effects in Nd-Fe-B magnets. First-principles calculations on Nd2Fe14B reveal that the magnetocrystalline anisotropy (K) is insensitive to the deformation along c axis and the ab in-plane shrinkage is responsible for the K reduction. The predicted K is more sensitive to the lattice deformation than what the previous phenomenological model suggests. The biaxial and triaxial stress states have a greater impact on K. Negative K occurs in a much wider strain range in the ab biaxial stress state. Micromagnetic simulations of Nd-Fe-B magnets using first-principles results show that a 3-4% local strain in a 2-nm-wide region near the interface around the grain boundaries and triple junctions leads to a negative local K and thus decreases the coercivity by ~60%. The local ab biaxial stress state is more likely to induce a large loss of coercivity. In addition to the local stress states and strain levels themselves, the shape of the interfaces and the intergranular phases also makes a difference in determining the coercivity. Smoothing the edge and reducing the sharp angle of the triple regions in Nd-Fe-B magnets would be favorable for a coercivity enhancement.Comment: 9 figure