Результаты поиска по 'thermal process':
Найдено статей: 32
  1. Chertov O.G., Nadporozhskaya M.A.
    Models of soil organic matter dynamics: problems and perspectives
    Computer Research and Modeling, 2016, v. 8, no. 2, pp. 391-399

    Soil as a complex multifunctional open system is one of the most difficult object for modeling. In spite of serious achievements in the soil system modeling, existed models do not reflect all aspects and processes of soil organic matter mineralization and humification. The problems and “hot spots” in the modeling of the dynamics of soil organic matter and biophylous elements were identified on a base of creation and wide implementation of ROMUL and EFIMOD models. The following aspects are discussed: further theoretical background; improving the structure of models; preparation and uncertainty of the initial data; inclusion of all soil biota (microorganisms, micro- and meso-fauna) as factors of humification; impact of soil mineralogy on C and N dynamics; hydro-thermal regime and organic matter distribution in whole soil profile; vertical and horizontal migration of soil organic matter. An effective feedback from modellers to experimentalists is necessary to solve the listed problems.

    Keywords: mathematic model, soil organic matter.
    Views (last year): 2. Citations: 3 (RSCI).
  2. Podryga V.O., Polyakov S.V.
    3D molecular dynamic simulation of thermodynamic equilibrium problem for heated nickel
    Computer Research and Modeling, 2015, v. 7, no. 3, pp. 573-579

    This work is devoted to molecular dynamic modeling of the thermal impact processes on the metal sample consisting of nickel atoms. For the solution of this problem, a continuous mathematical model on the basis of the classical Newton mechanics equations has been used; a numerical method based on the Verlet scheme has been chosen; a parallel algorithm has been offered, and its realization within the MPI and OpenMP technologies has been executed. By means of the developed parallel program, the investigation of thermodynamic equilibrium of nickel atoms’ system under the conditions of heating a sample to desired temperature has been executed. In numerical experiments both optimum parameters of calculation procedure and physical parameters of analyzed process have been defined. The obtained numerical results are well corresponding to known theoretical and experimental data.

    Keywords: molecular dynamic simulation, nickel, EAM, temperature, thermostat, Newton mechanics equations, parallel algorithm and program, MPI and OpenMP technologies.
    Views (last year): 2.
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