D.R. Mason D. Nguyen-Manh C.S. Becquart
We present an empirical interatomic potential for tungsten, particularly well suited for simulations of vacancy-type defects. We compare energies and structures of vacancy clusters generated with the empirical potential with an extensive new database of values computed using density functional theory, and show that the new potential predicts low-en…
Preprint PurchaseD.R. Mason A.E. Sand X. Yi S.L. Dudarev
Recently we have presented direct experimental evidence for large defect clusters being formed in primary damage cascades in self-ion irradiated tungsten [Yi et al., EPL 110:36001 (2015)]. This large size is significant, as it implies th…
Preprint PurchaseJ. Fikar R. Schäublin D.R. Mason D. Nguyen-Manh
The vacancies produced in high energy collision cascades can form in irradiated tungsten vacancy clusters or vacancy prismatic dislocation loops. Moreover, vacancy loop can easily transform to a planar vacancy cluster. We investigated the formation energies of these three types of vacancy defects as a function of number of vacancies using three EAM…
Preprint PublishedD. Mason
In radiation damage cascade displacement spikes ions and electrons can reach very high temperatures and be out of thermal equilibrium. Correct modelling of cascades with molecular dynamics should allow for the non-adiabatic exchange of energy between ions and electrons using a consistent model for the electronic stopping, electronic temperature ris…
Preprint PurchaseX. Yi A.E. Sand D.R. Mason M.A. Kirk S.G. Roberts K. Nordlund S.L. Dudarev
Using in-situ transmission electron microscopy, we have directly observed nano-scale defects formed in ultra-high purity tungsten by low-dose high energy self-ion irradiation at 30K. At cryogenic temperature lattice defects have reduced mobility, so these microscope observations over a window on the initial, primary damage caused by individual coll…
Preprint PublishedD.R. Mason X. Yi M.A. Kirk S.L. Dudarev
Using in situ transmission electron microscopy (TEM), we have observed nanometre scale dislocation loops formed when an ultra-high-purity tungsten foil is irradiated with a very low fluence of self-ions. Analysis of the TEM images has revealed the largest loops to be predominantly of prismatic 1/2{111} type and of vacancy character. The formation o…
Published