{ "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" [ [ 2.051273 2.837998 1.545633 ] [ 2.498541 2.310424 3.735737 ] [ 1.453493 4.519355 3.131974 ] [ 4.173987 2.427158 6.121254 ] [ 4.520065 2.264664 3.31985 ] [ 3.501394 4.313188 2.351729 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.051273e-10 2.837998e-10 1.545633e-10 ] [ 2.498541e-10 2.310424e-10 3.735737e-10 ] [ 1.453493e-10 4.519355e-10 3.131974e-10 ] [ 4.173987e-10 2.427158e-10 6.121254e-10 ] [ 4.520065e-10 2.264664e-10 3.31985e-10 ] [ 3.501394e-10 4.313188e-10 2.351729e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.571321 -4.651538 -10.5142131 ] [ -4.9100862 -9.5278461 8.8630431 ] [ -6.6179709 6.82662 3.7114513 ] [ 0.2708408 0.012021 -0.1951644 ] [ 7.7962505 -2.0828036 2.4284941 ] [ 9.0322869 9.4235467 -4.2936111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.926240253172077e-09 -7.45258543436279e-09 -1.684562641492909e-08 ] [ -7.866825315752714e-09 -1.526529226800046e-08 1.420016044396276e-08 ] [ -1.060315825311473e-08 1.09374509630857e-08 5.946400502097767e-09 ] [ 4.339347977187686e-10 1.92597651586368e-11 -3.126878388924595e-10 ] [ 1.249097028100031e-08 -3.337019233638075e-09 3.890876470770737e-09 ] [ 1.447131890353811e-08 1.509818620775699e-08 -6.87912332322737e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.0920278 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.749621410423658e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2630818 2.13565 1.6989327 ] [ 1.5875538 2.356644 4.0666318 ] [ 1.8697855 4.793094 3.7580281 ] [ 3.7430291 1.9408987 5.0148501 ] [ 5.1586721 3.250179 3.5954464 ] [ 3.5766308 4.1963214 2.0722878 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2630818e-10 2.13565e-10 1.6989327e-10 ] [ 1.5875538e-10 2.356644e-10 4.0666318e-10 ] [ 1.8697855e-10 4.793094e-10 3.7580281e-10 ] [ 3.7430291e-10 1.9408987e-10 5.014850100000001e-10 ] [ 5.158672100000001e-10 3.250179e-10 3.5954464e-10 ] [ 3.576630800000001e-10 4.1963214e-10 2.0722878e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.26e-05 -2.38e-05 -2.57e-05 ] [ -2.78e-05 -8.3e-06 1.3e-06 ] [ 2.42e-05 6e-06 2.54e-05 ] [ 2e-06 -1.07e-05 1.88e-05 ] [ -2e-06 3.35e-05 1.4e-06 ] [ 1.61e-05 3.3e-06 -2.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.018742542208e-14 -3.813180357504e-14 -4.117593915456e-14 ] [ -4.454051005824e-14 -1.329806595264e-14 2.08282960704e-15 ] [ 3.877267422336e-14 9.6130597248e-15 4.069528616832e-14 ] [ 3.2043532416e-15 -1.714328984256e-14 3.012092047104e-14 ] [ -3.2043532416e-15 5.36729167968e-14 2.24304726912e-15 ] [ 2.579504359488e-14 5.28718284864e-15 -3.412636202304e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9625962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.435966209331092e-18 } }