{ "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" [ [ 0.3126518 0.5217928 0.1846885 ] [ 0.8333114 2.588069 2.680495 ] [ 2.642381 0.0430457 2.992394 ] [ 2.45603 2.243401 1.184533 ] [ 2.245972 1.834771 2.762862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126518e-11 5.217928e-11 1.846885e-11 ] [ 8.333114000000001e-11 2.588069e-10 2.680495e-10 ] [ 2.642381e-10 4.30457e-12 2.992394e-10 ] [ 2.45603e-10 2.243401e-10 1.184533e-10 ] [ 2.245972e-10 1.834771e-10 2.762862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0686066 -0.0160487 -0.6559669 ] [ -58.5927867 28.7978401 7.5756587 ] [ 5.2706853 -20.6972808 3.6096139 ] [ 16.3460419 9.7270657 -55.1461606 ] [ 37.0446661 -17.8115763 44.6168549 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.099198905525773e-10 -2.571285193423296e-11 -1.050974831198651e-09 ] [ -9.387599299826119e-08 4.613922613775673e-08 1.213754325630012e-08 ] [ 8.444568763254235e-09 -3.316069941189272e-08 5.783239000694709e-09 ] [ 2.618924617479721e-08 1.558447725352559e-08 -8.835388924020211e-08 ] [ 5.935209795076232e-08 -2.853729112745536e-08 7.148408181440592e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.684083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.435479055088673e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6771426 0.8155932 0.8806183 ] [ 0.1983701 2.3959849 2.7104281 ] [ 2.259351 -0.4460019 2.7931888 ] [ 2.7047049 2.1587191 0.4805057 ] [ 2.6507776 2.3067843 2.9402316 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.771426000000001e-11 8.155932000000001e-11 8.806183e-11 ] [ 1.983701e-11 2.3959849e-10 2.7104281e-10 ] [ 2.259351e-10 -4.460019e-11 2.7931888e-10 ] [ 2.7047049e-10 2.1587191e-10 4.805057e-11 ] [ 2.6507776e-10 2.3067843e-10 2.9402316e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.9e-06 -6.2e-06 -8e-06 ] [ 1.36e-05 2.5e-06 -1.58e-05 ] [ -2.7e-06 2.9e-06 -9.8e-06 ] [ -3.01e-05 -9.4e-06 1.76e-05 ] [ 1.33e-05 1.01e-05 1.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.45284206272e-15 -9.93349504896e-15 -1.28174129664e-14 ] [ 2.178960204288e-14 4.005441552e-15 -2.531439060864e-14 ] [ -4.32587687616e-15 4.646312200320001e-15 -1.570133088384e-14 ] [ -4.822551628608e-14 -1.506046023552e-14 2.819830852608e-14 ] [ 2.130894905664e-14 1.618198387008e-14 2.547460827072e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.892431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.905377491267717e-18 } }