K. Barghorn et Er. Hilf, LOW-ENERGY CLUSTER-IMPACT SIMULATED BY MOLECULAR-DYNAMICS - ANGULAR-DISTRIBUTION OF SPUTTERING YIELD AND IMPACT UNDER VARIOUS IMPACT ANGLES, Nuclear instruments & methods in physics research. Section B, Beam interactions with materials and atoms, 88(1-2), 1994, pp. 196-201
The collision process of low energetic gold atoms and solid targets ha
s been simulated using our molecular dynamics simulation code CLIMPACT
II. The used algorithm is a third-order predictor Verlet algorithm [L
. Verlet, Phys. Rev. 159 (1967) 98; W.F. van Gusteren and H.J.C. Beren
dsen, in: Molecular Liquids - Dynamics and Interfaces, AJ. Barnes et a
l., eds. (Reidel, 1984) p. 475.]. The iteration time step is continuou
sly optimized by the program. About 50% of the total computer time is
spent to integrate the motions during the first 100 fs of simulation t
ime [B. Nitzschmann, Diploma thesis, Univ. of Oldenburg, Germany, 1992
)] When the crater formation ends and the motions in the target are sl
ower, the step increases up to 20 times the start step size. Using thi
s algorithm we are able to simulate a target of up to 105 particles. W
e use new nonreflecting boundary conditions. Only mechanical interacti
ons are considered. The projectile can be chosen as a cluster with var
iable impact angle. Specifically the output yield under different impa
ct angles and the distribution of the desorbed particles are presented
and discussed. The temporal development of the desorption shows three
distinct processes: an early explosive process, a surface ablation by
an apparent surface shock wave, a final thermal evaporation.