{ "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" [ [ 2.114 2.095272 1.915779 ] [ 2.14246 0.9228837 3.956719 ] [ 3.791491 3.03012 0.940196 ] [ 4.524648 0.3016751 5.057567 ] [ 3.666195 2.4276 3.537085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.114e-10 2.095272e-10 1.915779e-10 ] [ 2.14246e-10 9.228837e-11 3.956719e-10 ] [ 3.791491000000001e-10 3.03012e-10 9.40196e-11 ] [ 4.524648e-10 3.016751e-11 5.057567e-10 ] [ 3.666195e-10 2.4276e-10 3.537085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2532784 -1.5171174 -0.7599032 ] [ -1.1993836 -3.2010397 1.8417937 ] [ 2.5884377 0.9493736 -0.1917186 ] [ -1.783462 1.4187805 -1.6193483 ] [ 4.6476863 2.3500029 0.7291764 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.814503214233632e-09 -2.430690029288882e-09 -1.217499141111107e-09 ] [ -1.921624363290939e-09 -5.128630969592646e-09 2.950878806476729e-09 ] [ 4.147134367337324e-09 1.521064186324731e-09 -3.071670586925069e-10 ] [ -2.85742112048521e-09 2.273136947146935e-09 -2.594481987192225e-09 ] [ 7.446414330672456e-09 3.7651197051922e-09 1.168269380519109e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.98002 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.919410796071642e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9087144 2.0650868 2.0008265 ] [ 2.135106 0.7657873 3.9975032 ] [ 4.0606926 2.7216015 1.2550216 ] [ 4.4337652 0.5804907 4.5453084 ] [ 3.7005158 2.6445845 3.6086862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9087144e-10 2.0650868e-10 2.0008265e-10 ] [ 2.135106e-10 7.657873e-11 3.9975032e-10 ] [ 4.0606926e-10 2.7216015e-10 1.2550216e-10 ] [ 4.4337652e-10 5.804907e-11 4.5453084e-10 ] [ 3.7005158e-10 2.6445845e-10 3.6086862e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.8e-06 -2.9e-06 1.36e-05 ] [ 4.7e-06 -6.4e-06 -2.7e-06 ] [ 9.4e-06 6.8e-06 -7.8e-06 ] [ -1.17e-05 3.2e-06 3.6e-06 ] [ 4.5e-06 -6e-07 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.089480102144e-14 -4.646312200320001e-15 2.178960204288e-14 ] [ 7.53023011776e-15 -1.025393037312e-14 -4.32587687616e-15 ] [ 1.506046023552e-14 1.089480102144e-14 -1.249697764224e-14 ] [ -1.874546646336e-14 5.126965186560001e-15 5.76783583488e-15 ] [ 7.2097947936e-15 -9.6130597248e-16 -1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.06157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.252911870574266e-18 } }