DYNAMICS AND DIFFUSION OF RADICALS FORMED DURING UV IRRADIATION OF WATER ICE. MOLECULAR DYNAMICS STUDY |
| 2 | |
| 2013 |
| scientific article | 544.272+544.034.1 | ||
| 100-106 | water ice, simulation, classical molecular dynamics, photolysis processes, radicals, diffusion |
| A study of the behaviour of water molecules, hydrogen atoms and hydroxyl radicals in the crystalline water ice in the temperature range from 50 to 150 K has been carried out by the method of classical molecular dynamics. The particle motion character has been determined and diffusion and self-diffusion (for water molecules) coefficients in the given temperature range have been obtained. |
 |