{ "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" [ [ -1.099198914581844e-10 -2.571285214607579e-11 -1.050974839857415e-09 ] [ -9.387599377168597e-08 4.613922651788821e-08 1.213754335629881e-08 ] [ 8.44456883282728e-09 -3.316069968509683e-08 5.783239048341613e-09 ] [ 2.618924639056496e-08 1.558447738192285e-08 -8.835388996813141e-08 ] [ 5.93520984397519e-08 -2.853729136256817e-08 7.14840824033484e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.684083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.435479091631662e-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" [ [ 9.452842140600001e-15 -9.9334951308e-15 -1.2817413072e-14 ] [ 2.17896022224e-14 4.005441585e-15 -2.53143908172e-14 ] [ -4.3258769118e-15 4.6463122386e-15 -1.57013310132e-14 ] [ -4.82255166834e-14 -1.50604603596e-14 2.81983087584e-14 ] [ 2.13089492322e-14 1.61819840034e-14 2.54746084806e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.892431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.905377506965725e-18 } }