{ "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" [ [ -11.8832509 -8.0131379 -0.3191838 ] [ -4.5405318 -1.8770827 0.4160182 ] [ 3.471124 9.0316751 3.3356717 ] [ -0.1068473 8.4406692 -13.2399635 ] [ 13.059506 -7.5821238 9.8074574 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.903906692793947e-08 -1.283846230839983e-08 -5.113888263113292e-10 ] [ -7.274733955893961e-09 -3.007418042025632e-09 6.665346393587387e-10 ] [ 5.561353766516615e-09 1.447033881109961e-08 5.344335256435057e-09 ] [ -1.711882474659882e-10 1.352344296756347e-08 -2.121276015471286e-08 ] [ 2.09236353647828e-08 -1.214790158845529e-08 1.571327908523039e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.506749 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.683366774710286e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2095942 2.6548279 1.2301286 ] [ 2.2527832 4.0633518 3.4221255 ] [ 4.0289868 5.6513708 2.3666883 ] [ 3.985787 4.2428593 0.1746818 ] [ 4.6151538 2.9669582 2.5311119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2095942e-10 2.6548279e-10 1.2301286e-10 ] [ 2.2527832e-10 4.063351800000001e-10 3.4221255e-10 ] [ 4.0289868e-10 5.6513708e-10 2.3666883e-10 ] [ 3.985787e-10 4.2428593e-10 1.746818e-11 ] [ 4.6151538e-10 2.9669582e-10 2.5311119e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.4e-06 2.3e-06 -1.93e-05 ] [ -3e-07 -5.8e-06 2.7e-06 ] [ 8.5e-06 2.2e-05 -8.9e-06 ] [ -1.2e-05 -1.74e-05 3.47e-05 ] [ 1.4e-06 -1e-06 -9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.845223921599999e-15 3.685006258199999e-15 -3.09220090362e-14 ] [ -4.806529901999999e-16 -9.2926244772e-15 4.3258769118e-15 ] [ 1.3618501389e-14 3.5247885948e-14 -1.42593720426e-14 ] [ -1.9226119608e-14 -2.78778734316e-14 5.55955291998e-14 ] [ 2.2430472876e-15 -1.602176634e-15 -1.45798073694e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.98496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.561072940742464e-18 } }