{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.825886e-11 5.547803000000001e-11 6.819991e-11 ] [ 1.5038477e-10 3.675423900000001e-10 7.473714000000001e-11 ] [ 7.434880000000002e-12 2.3677418e-10 2.3220958e-10 ] [ 2.8586434e-10 1.5784047e-10 7.579505e-11 ] [ 2.3138708e-10 1.6879421e-10 3.1925423e-10 ] ] "source-value" [ [ 0.5825886 0.5547803 0.6819991 ] [ 1.5038477 3.6754239 0.7473714 ] [ 0.0743488 2.3677418 2.3220958 ] [ 2.8586434 1.5784047 0.7579505 ] [ 2.3138708 1.6879421 3.1925423 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.53921107960256e-12 1.64078907736128e-12 -9.9479146385472e-13 ] [ -1.27068627795648e-12 2.70976131875904e-12 -3.192336916944e-12 ] [ -2.24176552782336e-12 -1.57638157720512e-12 1.51998496015296e-12 ] [ 3.12616702250496e-12 -2.09756963195136e-12 7.49017570224e-13 ] [ 1.92565608053952e-12 -6.764389693017601e-13 1.91796563275968e-12 ] ] "source-value" [ [ -0.0009607 0.0010241 -0.0006209 ] [ -0.0007931 0.0016913 -0.0019925 ] [ -0.0013992 -0.0009839 0.0009487 ] [ 0.0019512 -0.0013092 0.0004675 ] [ 0.0012019 -0.0004222 0.0011971 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.835851517461087e-18 "source-value" -11.458484 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.044910464514794e-08 -1.610110839752695e-08 -1.702364233665423e-08 ] [ 1.618231872499375e-09 3.332003123051908e-08 -4.114454658650503e-08 ] [ -7.130910586260109e-08 2.14359334099454e-08 2.944843727581499e-08 ] [ 2.50472217290681e-08 -1.064885184968696e-08 -1.290605274707511e-08 ] [ 5.509275674596388e-08 -2.800600455346823e-08 4.162580439441939e-08 ] ] "source-value" [ [ -6.5218182 -10.0495215 -10.6253219 ] [ 1.0100209 20.7967279 -25.6804063 ] [ -44.5076435 13.3792574 18.380269 ] [ 15.6332463 -6.6464906 -8.0553246 ] [ 34.3861944 -17.4799733 25.9807838 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.519518706587586e-18 "source-value" 15.725599 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.859888e-11 7.922848000000001e-11 3.283142e-11 ] [ 1.326446e-10 2.971813e-10 1.139898e-10 ] [ 4.302915e-11 2.603801e-10 2.617302e-10 ] [ 2.920361000000001e-10 1.53739e-10 8.701039000000001e-11 ] [ 1.870212e-10 1.959004e-10 2.746341e-10 ] ] "source-value" [ [ 0.7859888 0.7922848 0.3283142 ] [ 1.326446 2.971813 1.139898 ] [ 0.4302915 2.603801 2.617302 ] [ 2.920361 1.53739 0.8701039 ] [ 1.870212 1.959004 2.746341 ] ] } "instance-id" 1 }