{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3142934 0.7540522 2.32218 ] [ 0.538251 2.820956 1.392978 ] [ 2.532298 0.1763292 2.432177 ] [ 1.796653 2.418536 0.8624239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.142934e-11 7.540522e-11 2.32218e-10 ] [ 5.38251e-11 2.820956e-10 1.392978e-10 ] [ 2.532298e-10 1.763292e-11 2.432177e-10 ] [ 1.796653e-10 2.418536e-10 8.624239e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7746725 -10.1164882 7.4414702 ] [ -48.3643675 20.3081689 18.1091978 ] [ 2.5841733 -2.3879132 1.1786398 ] [ 53.5548667 -7.8037674 -26.7293077 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.245639851387669e-08 -1.620840087863907e-08 1.19225495788199e-08 ] [ -7.748825888827934e-08 3.253727342283765e-08 2.90141333366028e-08 ] [ 4.140302045355584e-09 -3.825858701539714e-09 1.888389131904388e-09 ] [ 8.580435535680044e-08 -1.25030136824412e-08 -4.282507188710942e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.798657 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.890353240223827e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1179119 0.6872621 2.6764212 ] [ 0.1347216 2.7700055 1.4095471 ] [ 2.4560261 0.3149312 2.0953323 ] [ 2.4728358 2.3976747 0.8284583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.179119e-11 6.872621e-11 2.6764212e-10 ] [ 1.347216e-11 2.7700055e-10 1.4095471e-10 ] [ 2.4560261e-10 3.149312e-11 2.0953323e-10 ] [ 2.4728358e-10 2.3976747e-10 8.284583e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 -0.0 ] [ 1e-07 -2e-07 1e-07 ] [ -2e-07 2e-07 0.0 ] [ 1e-07 1e-07 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 1.6021766208e-16 -3.2043532416e-16 1.6021766208e-16 ] [ -3.2043532416e-16 3.2043532416e-16 0.0 ] [ 1.6021766208e-16 1.6021766208e-16 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.5906962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.21616359872354e-18 } }