{ "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" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2276944 -0.1687026 -2.5922081 ] [ -6.8803857 -0.7733434 3.2889813 ] [ -20.926438 0.7674921 0.1622942 ] [ 3.4927479 -9.4562421 -3.8677798 ] [ 2.6965933 -4.3630416 3.913104 ] [ 16.6606349 7.6551426 -5.7018547 ] [ 4.7291533 6.3386951 4.7974631 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.648066473726496e-10 -2.702913638150484e-10 -4.153175248285535e-09 ] [ -1.102359320144773e-08 -1.239032725538116e-09 5.269528988522944e-09 ] [ -3.352784999644969e-08 1.229657909399591e-09 2.600239750737228e-10 ] [ 5.595999073832568e-09 -1.515057013806709e-08 -6.196866421017192e-09 ] [ 4.320418776660951e-09 -6.990363304689974e-09 6.269483795211936e-09 ] [ 2.669327994438493e-08 1.226489060365801e-08 -9.135378370803079e-09 ] [ 7.576938915863992e-09 1.015570917927029e-08 7.686383281297205e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.437943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.793866481962386e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3626504 1.148563 1.4128681 ] [ 1.107754 1.8283715 3.92931 ] [ 1.329721 3.7114661 1.9514157 ] [ 3.8694675 1.1571455 1.7023641 ] [ 3.6341113 1.1992658 4.2145039 ] [ 3.9263263 3.6783292 1.6106385 ] [ 3.0551216 3.7499797 4.0795367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3626504e-10 1.148563e-10 1.4128681e-10 ] [ 1.107754e-10 1.8283715e-10 3.92931e-10 ] [ 1.329721e-10 3.7114661e-10 1.9514157e-10 ] [ 3.8694675e-10 1.1571455e-10 1.7023641e-10 ] [ 3.6341113e-10 1.1992658e-10 4.214503900000001e-10 ] [ 3.9263263e-10 3.6783292e-10 1.6106385e-10 ] [ 3.0551216e-10 3.7499797e-10 4.0795367e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-06 5.7e-06 7e-06 ] [ 4.3e-06 -3.2e-06 -2.7e-06 ] [ 1.2e-06 -1.6e-06 -2e-07 ] [ 3e-07 3e-07 -1e-07 ] [ -4.1e-06 6e-07 -1.7e-06 ] [ -9e-07 -1.3e-06 2.8e-06 ] [ -1.8e-06 -6e-07 -5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-15 9.1324068138e-15 1.1215236438e-14 ] [ 6.8893595262e-15 -5.1269652288e-15 -4.3258769118e-15 ] [ 1.9226119608e-15 -2.5634826144e-15 -3.204353268e-16 ] [ 4.806529901999999e-16 4.806529901999999e-16 -1.602176634e-16 ] [ -6.568924199399999e-15 9.613059803999998e-16 -2.7237002778e-15 ] [ -1.4419589706e-15 -2.0828296242e-15 4.486094575199999e-15 ] [ -2.8839179412e-15 -9.613059803999998e-16 -8.1711008334e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.044153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.8522980120921e-18 } }