Generalized Langevin equation: An efficient approach to nonequilibrium molecular dynamics of open systems

L Stella, CD Lorenz, L Kantorovich - Physical Review B, 2014 - APS
The generalized Langevin equation (GLE) has been recently suggested to simulate the time
evolution of classical solid and molecular systems when considering general nonequilibrium …

Molecular dynamics simulations of amorphous hydrogenated carbon under high hydrogen fluxes

ED de Rooij, U von Toussaint, AW Kleyn… - Physical Chemistry …, 2009 - pubs.rsc.org
We study the flux dependence of the carbon erosion yield and the hydrogen enrichment of
the surface in the high flux regime at 1028 ions per m2 s and higher by using molecular …

The influence of helium ion irradiation on amorphous hydrocarbon films

H Fan, L Sun, D Yang, J Niu, L Guo, Q Yang… - Journal of nuclear …, 2013 - Elsevier
Amorphous hydrocarbon films were irradiated with 60–140keV He ions at the dose ranging
from 1.0× 1015 to 1.0× 1017ions/cm2. The films about 1.4 μm thick were deposited on Si …

[PDF][PDF] Molecular dynamics simulations of interactions between hydrogen and fusion-relevant materials

D de Rooij - 2010 - pure.mpg.de
This work, supported by the European Communities under the contract of Association
between EURATOM/FOM, was carried out within the framework of the European Fusion …

Molecular dynamics simulations of synergistic erosion of amorphous hydrocarbon films

U Von Toussaint, PN Maya, C Hopf, M Schlüter - Physica Scripta, 2009 - iopscience.iop.org
The erosion of amorphous hydrocarbon films by bombardment with argon ions and
simultaneous exposure to thermal atomic hydrogen is studied as a function of ion energy …