{ "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" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3822159 -1.2337814 -0.8280371 ] [ 5.0193766 0.2183359 -2.3960275 ] [ 0.7823314 -1.1677287 3.6950639 ] [ -2.3681948 2.48436 -0.4836941 ] [ 0.9487028 -0.3011859 0.0126948 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.021083862278032e-09 -1.976735714257893e-09 -1.326661682775032e-09 ] [ 8.041927839510593e-09 3.498126744613267e-10 -3.838859243293873e-09 ] [ 1.253433078797733e-09 -1.870907622577177e-09 5.920144992942069e-09 ] [ -3.794266342060132e-09 3.980383509650689e-09 -7.749633786388974e-10 ] [ 1.519989446247498e-09 -4.825530074946067e-10 2.033931176573184e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5479123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.888735381308757e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2834317 2.9928389 3.3728666 ] [ 3.880478 3.3831341 3.102852 ] [ 2.2527433 2.0210174 3.8262449 ] [ 0.6940645 4.9555878 2.3692868 ] [ 2.917159 5.1968027 2.2024096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.834317e-11 2.9928389e-10 3.3728666e-10 ] [ 3.880478e-10 3.3831341e-10 3.102852e-10 ] [ 2.2527433e-10 2.0210174e-10 3.8262449e-10 ] [ 6.940645e-11 4.9555878e-10 2.3692868e-10 ] [ 2.917159e-10 5.196802700000001e-10 2.2024096e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-06 7e-07 0.0 ] [ -1.1e-05 -5.8e-06 3.7e-06 ] [ 5.8e-06 -1.02e-05 4.4e-06 ] [ 6.3e-06 5e-06 -2.8e-06 ] [ -6.5e-06 1.02e-05 -5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-15 1.12152363456e-15 0.0 ] [ -1.76239428288e-14 -9.292624400640001e-15 5.928053496960001e-15 ] [ 9.292624400640001e-15 -1.634220153216e-14 7.04957713152e-15 ] [ 1.009371271104e-14 8.010883104e-15 -4.48609453824e-15 ] [ -1.04141480352e-14 1.634220153216e-14 -8.491536090240001e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9680601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.436841622614931e-18 } }