{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 10.7884271 -19.3190528 -22.5906644 ] [ -25.6993243 23.1890778 23.9727522 ] [ -9.0422292 -11.7287705 13.0731389 ] [ 3.628284 -2.1685149 -20.8671899 ] [ 6.1475639 7.535208 11.6802681 ] [ 10.3114481 -6.9589231 -12.4458989 ] [ 3.8658303 9.4509755 7.1775941 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.728496567482514e-08 -3.095253473216078e-08 -3.619423435001886e-08 ] [ -4.117485656381733e-08 3.71529983090723e-08 3.840858311107176e-08 ] [ -1.448724822415509e-08 -1.879156188582873e-08 2.094547750605103e-08 ] [ 5.813151798422706e-09 -3.47434387463645e-09 -3.343292379957389e-08 ] [ 9.84948315545407e-09 1.207273409046513e-08 1.871385247449604e-08 ] [ 1.652076107241258e-08 -1.114942389676506e-08 -1.994052824242044e-08 ] [ 6.19374292664025e-09 1.514213198985359e-08 1.149977346061202e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.4368153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.191509160686774e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.529627 1.3397513 1.4403988 ] [ 1.4242397 3.0797985 3.1282295 ] [ 2.432424 1.5464269 4.9130876 ] [ 2.6092006 3.8322104 0.7411556 ] [ 4.3539908 3.2068506 5.4212144 ] [ 4.4198733 1.6369242 3.1410029 ] [ 3.8400626 4.2635211 3.0469574 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.529627e-10 1.3397513e-10 1.4403988e-10 ] [ 1.4242397e-10 3.0797985e-10 3.1282295e-10 ] [ 2.432424e-10 1.5464269e-10 4.9130876e-10 ] [ 2.6092006e-10 3.8322104e-10 7.411556000000001e-11 ] [ 4.3539908e-10 3.2068506e-10 5.421214400000001e-10 ] [ 4.4198733e-10 1.6369242e-10 3.1410029e-10 ] [ 3.8400626e-10 4.2635211e-10 3.0469574e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.9e-06 1.16e-05 -9.6e-06 ] [ -1.45e-05 7.6e-06 1.61e-05 ] [ -1.4e-06 -9.6e-06 1.76e-05 ] [ 7.7e-06 -1.02e-05 2e-06 ] [ -1.46e-05 8e-06 -3.5e-06 ] [ 9.8e-06 -1.13e-05 -1.59e-05 ] [ 7.1e-06 3.9e-06 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.45284206272e-15 1.858524880128e-14 -1.538089555968e-14 ] [ -2.32315610016e-14 1.217654231808e-14 2.579504359488e-14 ] [ -2.24304726912e-15 -1.538089555968e-14 2.819830852608e-14 ] [ 1.233675998016e-14 -1.634220153216e-14 3.2043532416e-15 ] [ -2.339177866368e-14 1.28174129664e-14 -5.6076181728e-15 ] [ 1.570133088384e-14 -1.810459581504e-14 -2.547460827072e-14 ] [ 1.137545400768e-14 6.24848882112e-15 -1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.43444 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.754611188954035e-18 } }