{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.4118538e-10 2.356208e-11 -5.121412e-11 ] [ -4.306006e-11 -2.5113826e-10 6.2342342e-10 ] [ 5.8858791e-10 -1.9348369e-10 2.0442004e-10 ] [ 4.2081059e-10 3.0931886e-10 7.2799882e-10 ] [ 9.219847400000001e-10 4.6135987e-10 1.8413673e-10 ] [ 3.1516761e-10 5.761379e-10 -2.1439016e-10 ] [ 3.4882779e-10 9.66749e-10 4.0733038e-10 ] ] "source-value" [ [ -1.4118538 0.2356208 -0.5121412 ] [ -0.4306006 -2.5113826 6.2342342 ] [ 5.8858791 -1.9348369 2.0442004 ] [ 4.2081059 3.0931886 7.2799882 ] [ 9.2198474 4.6135987 1.8413673 ] [ 3.1516761 5.761379 -2.1439016 ] [ 3.4882779 9.66749 4.0733038 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.2043532416e-16 -1.6021766208e-16 -1.6021766208e-16 ] [ -4.8065298624e-16 -6.408706483200001e-16 1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ 4.8065298624e-16 -1.6021766208e-16 4.8065298624e-16 ] [ 1.6021766208e-16 0.0 1.6021766208e-16 ] [ 0.0 3.2043532416e-16 -3.2043532416e-16 ] [ 0.0 6.408706483200001e-16 -3.2043532416e-16 ] ] "source-value" [ [ -2e-07 -1e-07 -1e-07 ] [ -3e-07 -4e-07 1e-07 ] [ 0.0 0.0 0.0 ] [ 3e-07 -1e-07 3e-07 ] [ 1e-07 -0.0 1e-07 ] [ 0.0 2e-07 -2e-07 ] [ -0.0 4e-07 -2e-07 ] ] } "species" { "source-value" [ "Si" "Si" "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" 5.720535094939446e-31 "source-value" 3.5704772e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.099673694545581e-08 -3.062731883339964e-09 -8.89950184798287e-09 ] [ -7.686720476149372e-09 -8.908588112034752e-09 8.174963133259763e-09 ] [ 9.513836606238533e-09 -1.115956311129213e-08 -1.198658986009457e-09 ] [ -9.481969633686144e-11 3.114380129541059e-09 1.256032386060254e-08 ] [ 1.239918286413597e-08 2.697624991074142e-09 -2.861208986452105e-09 ] [ -2.685162780664573e-09 6.759756358447908e-09 -1.154292296092808e-08 ] [ -4.495795717678944e-10 1.05591217878214e-08 3.767005787510206e-09 ] ] "source-value" [ [ -6.8636234 -1.9116069 -5.5546322 ] [ -4.7976736 -5.5603034 5.1024107 ] [ 5.9380698 -6.9652515 -0.7481441 ] [ -0.0591818 1.9438432 7.8395376 ] [ 7.7389613 1.6837251 -1.7858262 ] [ -1.6759468 4.2191081 -7.2045259 ] [ -0.2806055 6.5904855 2.3511801 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 8.470501594038503e-18 "source-value" 52.868713 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] "source-value" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] } "instance-id" 1 }