{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5175959 0.4899044 -2.6728994 ] [ 1.5739727 -9.2000185 4.1947773 ] [ -10.4866664 1.7933721 -4.1407944 ] [ -1.7680482 -3.0106741 -8.5863254 ] [ 1.1299208 3.4923445 8.5875505 ] [ 4.7986536 -0.3675232 -6.0560526 ] [ 5.2697633 6.8025949 8.673744 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.292800568342004e-10 7.849133825737896e-10 -4.282456963712619e-09 ] [ 2.521782282493891e-09 -1.474005467306773e-08 6.720774174893608e-09 ] [ -1.68014918746329e-08 2.873298874687511e-09 -6.634284033878049e-09 ] [ -2.832725513825759e-09 -4.823631695608979e-09 -1.37568099278007e-08 ] [ 1.810332704030587e-09 5.595352755778413e-09 1.375877275439502e-08 ] [ 7.688290672579981e-09 -5.888370834929087e-10 -9.702865969994948e-09 ] [ 8.443091625970731e-09 1.089895859934757e-08 1.389686996609769e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.335454 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.457010607058184e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5608507 2.5486217 1.049667 ] [ 3.2584591 2.5325686 3.5016678 ] [ 1.7215803 4.3485902 2.585531 ] [ 4.9499242 2.066417 1.6521027 ] [ 5.5871795 3.5683511 3.5602997 ] [ 4.1061366 4.4717523 1.6922457 ] [ 3.5919547 4.9788191 4.1371861 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5608507e-10 2.5486217e-10 1.049667e-10 ] [ 3.2584591e-10 2.5325686e-10 3.5016678e-10 ] [ 1.7215803e-10 4.348590200000001e-10 2.585531e-10 ] [ 4.9499242e-10 2.066417e-10 1.6521027e-10 ] [ 5.587179500000001e-10 3.5683511e-10 3.5602997e-10 ] [ 4.1061366e-10 4.471752300000001e-10 1.6922457e-10 ] [ 3.5919547e-10 4.9788191e-10 4.1371861e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 2.41e-05 -1.5e-06 ] [ -4e-07 1.37e-05 0.0 ] [ 6.2e-06 -1.42e-05 -1.13e-05 ] [ -1.2e-06 -1.62e-05 -1.1e-06 ] [ -5.1e-06 2.89e-05 1.5e-06 ] [ -8.1e-06 -1.7e-05 1.57e-05 ] [ 1.36e-05 -1.93e-05 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.1711008334e-15 3.86124568794e-14 -2.403264951e-15 ] [ -6.408706536e-16 2.19498198858e-14 0.0 ] [ 9.9334951308e-15 -2.27509082028e-14 -1.81045959642e-14 ] [ -1.9226119608e-15 -2.59552614708e-14 -1.7623942974e-15 ] [ -8.1711008334e-15 4.63029047226e-14 2.403264951e-15 ] [ -1.29776307354e-14 -2.723700277799999e-14 2.515417315379999e-14 ] [ 2.17896022224e-14 -3.09220090362e-14 -5.2871828922e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.11232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.542784242753088e-18 } }