{ "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" [ [ 1.203026 0.2649124 0.0761432 ] [ 0.4390709 0.810708 2.186548 ] [ 0.3000789 2.890506 0.2564829 ] [ 2.996181 0.8499925 2.546793 ] [ 2.861384 1.542152 0.2554234 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.203026e-10 2.649124e-11 7.61432e-12 ] [ 4.390709e-11 8.107080000000001e-11 2.186548e-10 ] [ 3.000789e-11 2.890506e-10 2.564829e-11 ] [ 2.996181e-10 8.499925000000001e-11 2.546793e-10 ] [ 2.861384e-10 1.542152e-10 2.554234e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8862209 1.0459921 8.4918108 ] [ 2.7090811 -2.434646 -8.4489615 ] [ 0.0 0.0 0.0 ] [ -0.3145414 2.3309187 -7.3942504 ] [ 2.4916812 -0.9422648 7.3514011 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.828588890044334e-09 1.675864088161496e-09 1.360538073201694e-08 ] [ 4.340426402271147e-09 -3.900732901124237e-09 -1.35367285853393e-08 ] [ 0.0 0.0 0.0 ] [ -5.039508773537011e-10 3.734543446125528e-09 -1.184689511922105e-08 ] [ 3.992113365126888e-09 -1.509674633162788e-09 1.17782429725434e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5278037 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.254341231711737e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7520808 1.2971567 0.7503904 ] [ -0.6281932 -0.1899898 1.603842 ] [ -0.0320963 2.983754 -0.4390066 ] [ 4.7901119 1.1558838 2.2808648 ] [ 2.9178375 1.1114662 1.1253 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.520808000000001e-11 1.2971567e-10 7.503904000000001e-11 ] [ -6.281932e-11 -1.899898e-11 1.603842e-10 ] [ -3.20963e-12 2.983754e-10 -4.390066e-11 ] [ 4.7901119e-10 1.1558838e-10 2.2808648e-10 ] [ 2.9178375e-10 1.1114662e-10 1.1253e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1374048 0.6197949 -0.4070082 ] [ -0.325719 -0.3449137 0.1879797 ] [ 0.1348857 -0.2841122 0.191445 ] [ -0.0020893 -0.0090725 -0.0378953 ] [ 0.0555178 0.0183034 0.0654788 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.201467581456998e-10 9.930208984710741e-10 -6.520990225138905e-10 ] [ -5.218593667503552e-10 -5.526126663336249e-10 3.011766805249978e-10 ] [ 2.161107150202426e-10 -4.551979245240537e-10 3.06728703169056e-10 ] [ -3.34742761383744e-12 -1.4535747392208e-11 -6.071496369820223e-11 ] [ 8.894932119825024e-11 2.932527956115073e-11 1.04908602518039e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.266266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.644837136811393e-18 } }