Published: On

Generated Forcefields

EAM forcefields for Zr and Zr-H system

As reported in

M. Christensen, W. Wolf, C. Freeman, E. Wimmer, R.B. Adamson, L. Hallstadius, P.E. Cantonwine, and E.V. Mader
"Diffusion of point defects, nucleation of dislocation loops, and effect of hydrogen in hcp-Zr: Ab initio and classical simulations"
Journal of Nuclear Materials 460, 82 (2015)

M Christensen, W Wolf, CM Freeman, E Wimmer, RB Adamson, L Hallstadius, PE Cantonwine, et al. “Effect of Alloying Elements on the Properties of Zr and the Zr–H System.” Journal of Nuclear Materials 445, no. 1: 241–250. (2014)

Feel free to use and share the attached files in accordance with the Creative Commons Attribution-Share Alike Public License.

Zr_V12.fs709.28 KB
ZrH_V4.fs1.66 MB
ZrFe_V12.fs1.62 MB
ZrCr_V12.fs1.63 MB
ZrSn_V12.fs1.63 MB
ZrO_V12.fs1.63 MB
ZrNb_V12.fs1.63 MB