{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0952243 -1.7330052 -14.3036808 ] [ -6.5824379 -7.8503276 12.3996255 ] [ -3.0859773 4.0036758 0.0296778 ] [ 2.7853775 -2.8617798 -0.582813 ] [ 6.9782621 8.4414367 2.4571905 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.525661471920454e-10 -2.776580415164828e-09 -2.291702296914584e-08 ] [ -1.054622811124785e-08 -1.257761134634097e-08 1.986639008277551e-08 ] [ -4.944280682379508e-09 6.414595764022737e-09 4.754907731677824e-11 ] [ 4.462666710602352e-09 -4.585076689437699e-09 -9.337693628983104e-10 ] [ 1.118040839043471e-08 1.35246725267031e-08 3.936853171951862e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5874328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.349877581651083e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.9962277 2.811622 0.6008002 ] [ 2.3715463 2.1368381 3.8180118 ] [ 2.0635037 4.2821124 2.4681355 ] [ 4.5453037 2.0483926 2.4815186 ] [ 4.5454366 4.5472969 3.0056699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9962277e-10 2.811622e-10 6.008002e-11 ] [ 2.3715463e-10 2.1368381e-10 3.8180118e-10 ] [ 2.0635037e-10 4.2821124e-10 2.4681355e-10 ] [ 4.5453037e-10 2.0483926e-10 2.4815186e-10 ] [ 4.5454366e-10 4.5472969e-10 3.0056699e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 3.2e-06 4.6e-06 ] [ 7e-07 6e-07 -1.4e-06 ] [ 3e-07 -1.4e-06 1e-06 ] [ -1.9e-06 5e-07 8e-07 ] [ -2.4e-06 -2.9e-06 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 5.126965186560001e-15 7.370012455680001e-15 ] [ 1.12152363456e-15 9.6130597248e-16 -2.24304726912e-15 ] [ 4.8065298624e-16 -2.24304726912e-15 1.6021766208e-15 ] [ -3.04413557952e-15 8.010883104e-16 1.28174129664e-15 ] [ -3.84522388992e-15 -4.646312200320001e-15 -8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.212408 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.796425796047089e-18 } }