{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5454374 2.2794384 2.3821309 ] [ 1.681607 -4.2265692 -2.9732119 ] [ -0.3235076 1.2857634 -0.5129659 ] [ 0.3312763 1.5328229 -1.1550439 ] [ 0.8560616 -0.8714555 2.2590908 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.078240325589711e-09 3.652062943122346e-09 3.816594467109391e-09 ] [ 2.694231442970838e-09 -6.771710414224073e-09 -4.763610634110744e-09 ] [ -5.183163176414183e-10 2.060020076332395e-09 -8.218619790187805e-10 ] [ 5.307631472579741e-10 2.455853034440118e-09 -1.850584347824232e-09 ] [ 1.371561892784654e-09 -1.396225639670787e-09 3.619462493844367e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.43322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992021456938148e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3088474 2.7285997 1.2887922 ] [ 2.3464942 4.0464866 3.325248 ] [ 4.0043675 5.5192655 2.3414934 ] [ 3.966722 4.2013775 0.3050387 ] [ 4.4658739 3.0836386 2.4641639 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3088474e-10 2.7285997e-10 1.2887922e-10 ] [ 2.3464942e-10 4.0464866e-10 3.325248e-10 ] [ 4.0043675e-10 5.5192655e-10 2.3414934e-10 ] [ 3.966722e-10 4.201377500000001e-10 3.050387e-11 ] [ 4.4658739e-10 3.0836386e-10 2.4641639e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-06 -3e-07 2.1e-06 ] [ 0.0 0.0 -1.8e-06 ] [ 8e-07 -1.6e-06 1.2e-06 ] [ 3e-07 -8e-07 1.8e-06 ] [ -2.3e-06 2.8e-06 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.9226119608e-15 -4.806529901999999e-16 3.364570931399999e-15 ] [ 0.0 0.0 -2.8839179412e-15 ] [ 1.2817413072e-15 -2.5634826144e-15 1.9226119608e-15 ] [ 4.806529901999999e-16 -1.2817413072e-15 2.8839179412e-15 ] [ -3.685006258199999e-15 4.486094575199999e-15 -5.1269652288e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888462318406e-18 } }