Перегляд за автором "Gurskii, Z."

Результати 1-4 з 4

Ab initio derivation of interatomic interactions in transition metals

Gurskii, Z.; Krawczyk, J. (Condensed Matter Physics, 2001)

An approach to the ab-initio calculation of many-body interatomic potentials in transition metals (TM) is developed. It is based on utilizing the local spin density approximation and linear superposition assumption for ...
Atomic static displacements and their effect on the short range order in alloys

Gurskii, Z.; Khokhlov, Yu. (Condensed Matter Physics, 1998)

The influence of local atomic static displacements (ASD) on the short range order formation in binary alloys is investigated within the microscopic theory. Explicit expression for the binary correlation function Fourier ...
How does one extract many-body interatomic potentials from ab-initio band structure calculations

Gurskii, Z.; Krawczyk, J. (Condensed Matter Physics, 1999)

An original approach to the ab-initio deriving many-body interatomic potentials in metals is discussed. It is based on calculating the Kohn-Sham total energy functional using the pseudopotential method. The local density ...
On collective variables method in the microscopic theory of alloys

Gurskii, Z. (Condensed Matter Physics, 2000)

Ab initio approach is developed for thermodynamical investigations of disordered binary alloys. It is based on utilizing the collective variables method. The explicit expression for the free energy and the equation determining ...

Результати 1-4 з 4

Пошук