{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3841747 -0.1901911 1.5743903 ] [ 0.3267291 0.4013931 -0.8215996 ] [ 1.1244669 -0.540928 -1.2507639 ] [ 0.6991215 1.5584415 -0.5703588 ] [ -3.0113247 -1.1111485 2.9002459 ] [ -0.9908669 -0.7072921 0.2770068 ] [ 1.4676994 0.5897251 -2.1089207 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.155157226428538e-10 -3.047197339042349e-10 2.522451330674298e-09 ] [ 5.234777253550253e-10 6.431026405704365e-10 -1.316347670778632e-09 ] [ 1.801594578043452e-09 -8.666621951361024e-10 -2.003944678720629e-09 ] [ 1.120116122398627e-09 2.496898536184483e-09 -9.138155348275431e-10 ] [ -4.824674031977573e-09 -1.780256148936989e-09 4.646706175551055e-09 ] [ -1.587543781504571e-09 -1.133206866696536e-09 4.438138187626215e-10 ] [ 2.351513665042187e-09 9.44843767918942e-10 -3.378863440661171e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.798101 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.77418207664371e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4135196 2.2752658 2.0280896 ] [ 2.2366859 2.8696542 4.4189299 ] [ 2.0646164 0.6211681 3.8289037 ] [ 4.0362251 0.2088298 2.6978606 ] [ 4.6994871 2.2152868 1.5900057 ] [ 4.1166722 1.372398 4.9720473 ] [ 4.2877998 3.4962069 3.5605152 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4135196e-10 2.2752658e-10 2.0280896e-10 ] [ 2.2366859e-10 2.8696542e-10 4.4189299e-10 ] [ 2.0646164e-10 6.211681000000001e-11 3.8289037e-10 ] [ 4.0362251e-10 2.088298e-11 2.6978606e-10 ] [ 4.6994871e-10 2.2152868e-10 1.5900057e-10 ] [ 4.1166722e-10 1.372398e-10 4.9720473e-10 ] [ 4.2877998e-10 3.4962069e-10 3.5605152e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.9e-06 -1.39e-05 3.48e-05 ] [ -2e-06 -3.7e-05 -3.1e-06 ] [ 2.61e-05 5.25e-05 -6.5e-06 ] [ -2.1e-06 1.14e-05 2.04e-05 ] [ -1.3e-06 2.27e-05 1.34e-05 ] [ -2.92e-05 4.9e-06 -2.92e-05 ] [ 3.6e-06 -4.07e-05 -2.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.850665441919999e-15 -2.227025502912e-14 5.575574640383999e-14 ] [ -3.2043532416e-15 -5.92805349696e-14 -4.96674752448e-15 ] [ 4.181680980288e-14 8.4114272592e-14 -1.04141480352e-14 ] [ -3.36457090368e-15 1.826481347712e-14 3.268440306432e-14 ] [ -2.08282960704e-15 3.636940929216e-14 2.146916671872e-14 ] [ -4.678355732736e-14 7.850665441919999e-15 -4.678355732736e-14 ] [ 5.76783583488e-15 -6.520858846656e-14 -4.774486329984001e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.196266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.158410466225794e-18 } }