{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.8447925 3.1254272 -7.5570181 ] [ -30.6031613 -6.1338631 51.0656252 ] [ 39.3038872 -15.9224863 -31.2239252 ] [ 2.7236148 19.161687 -11.1960899 ] [ -0.5795482 -0.2307647 -1.088592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.737527314407844e-08 5.007486431108044e-09 -1.210767782253507e-08 ] [ -4.903166996139306e-08 -9.827532134974804e-09 8.181615149604157e-08 ] [ 6.297176969721168e-08 -2.551063550504511e-08 -5.002624337720377e-08 ] [ 4.363711992576583e-09 3.070040717942155e-08 -1.793811362994339e-08 ] [ -9.285385843167587e-10 -3.697258102920197e-10 -1.744116666359328e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.990042 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.994928695078627e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8800164 1.8792531 0.0471052 ] [ 0.9770164 1.4703014 2.7260635 ] [ 3.1579933 1.0662148 1.2129658 ] [ 2.1076084 3.6530496 1.6458729 ] [ 4.6563316 3.172774 1.4803004 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.800164000000001e-11 1.8792531e-10 4.71052e-12 ] [ 9.770164e-11 1.4703014e-10 2.7260635e-10 ] [ 3.1579933e-10 1.0662148e-10 1.2129658e-10 ] [ 2.1076084e-10 3.6530496e-10 1.6458729e-10 ] [ 4.6563316e-10 3.172774e-10 1.4803004e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.15e-05 -2.4e-06 -3.81e-05 ] [ 3.28e-05 1.92e-05 2.81e-05 ] [ -2.9e-06 6.67e-05 2e-06 ] [ 4e-05 -3.54e-05 1.36e-05 ] [ -0.0001014 -4.81e-05 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.046856397099999e-14 -3.845223921599999e-15 -6.10429297554e-14 ] [ 5.255139359519999e-14 3.076179137279999e-14 4.50211634154e-14 ] [ -4.6463122386e-15 1.068651814878e-13 3.204353268e-15 ] [ 6.408706535999999e-14 -5.671705284359999e-14 2.17896022224e-14 ] [ -1.624607106876e-13 -7.706469609539999e-14 -8.972189150399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.624493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.663537423669656e-18 } }