{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8074524 -17.2539558 -0.6291715 ] [ -8.5343632 11.7602343 -4.5653619 ] [ -2.9683338 4.7412244 8.0431357 ] [ 0.7975944 -3.011501 0.5841987 ] [ 12.6585084 2.2611934 -4.9581156 ] [ 2.8540467 1.5028047 1.5253146 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.70238784088885e-09 -2.764388459907656e-08 -1.008043867773667e-09 ] [ -1.367355719245587e-08 1.884197245059026e-08 -7.314516101671068e-09 ] [ -4.755795017090423e-09 7.596278887646508e-09 1.288652397646184e-08 ] [ 1.277887100561004e-09 -4.824956495715821e-09 9.359894990417529e-10 ] [ 2.028116621268042e-08 3.622831200587263e-09 -7.943776897543765e-09 ] [ 4.572686897411391e-09 2.407758555968358e-09 2.443823391484904e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.1666707 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.869212519712371e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0822024 0.4430471 0.8715251 ] [ 0.1349245 2.8052695 0.5701595 ] [ 0.4010594 3.3808009 2.9595355 ] [ 1.6414671 -0.002671 2.4725527 ] [ 2.6031831 2.857276 0.4429547 ] [ 2.5568175 2.1789948 2.8197107 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.22024e-12 4.430471e-11 8.715251e-11 ] [ 1.349245e-11 2.8052695e-10 5.701595000000001e-11 ] [ 4.010594e-11 3.3808009e-10 2.9595355e-10 ] [ 1.6414671e-10 -2.671e-13 2.4725527e-10 ] [ 2.6031831e-10 2.857276e-10 4.429547e-11 ] [ 2.5568175e-10 2.1789948e-10 2.8197107e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.4e-06 2.33e-05 2.16e-05 ] [ 1.41e-05 -1.1e-05 -2.1e-06 ] [ 4.3e-06 -2.58e-05 -1.31e-05 ] [ -1.08e-05 -7e-07 7e-07 ] [ -6.7e-06 1.08e-05 9.4e-06 ] [ -7.3e-06 3.4e-06 -1.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.025393037312e-14 3.733071526464e-14 3.460701500928e-14 ] [ 2.259069035328e-14 -1.76239428288e-14 -3.36457090368e-15 ] [ 6.889359469440001e-15 -4.133615681664e-14 -2.098851373248e-14 ] [ -1.730350750464e-14 -1.12152363456e-15 1.12152363456e-15 ] [ -1.073458335936e-14 1.730350750464e-14 1.506046023552e-14 ] [ -1.169588933184e-14 5.44740051072e-15 -2.64359142432e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9625962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.435966209331092e-18 } }