{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5353879 0.9970923 2.660459 ] [ 0.8434423 2.30713 1.528251 ] [ 1.912844 1.041012 0.0827139 ] [ 2.263312 0.2132627 1.656325 ] [ 2.91731 1.870919 1.650254 ] [ 2.184429 2.813613 2.907386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.353879e-11 9.970923e-11 2.660459e-10 ] [ 8.434423e-11 2.30713e-10 1.528251e-10 ] [ 1.912844e-10 1.041012e-10 8.27139e-12 ] [ 2.263312e-10 2.132627e-11 1.656325e-10 ] [ 2.91731e-10 1.870919e-10 1.650254e-10 ] [ 2.184429e-10 2.813613e-10 2.907386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2972447 -11.8038201 -0.6008128 ] [ -33.1555227 24.4484388 -5.356787 ] [ -4.49101 -7.9180525 -27.4180959 ] [ 8.972486 -22.6559851 10.3194002 ] [ 17.7833854 4.9174256 12.5669064 ] [ 14.1879059 13.0119932 10.4893892 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28276841492034e-09 -1.891180475615954e-08 -9.626082295681152e-10 ] [ -5.312100375799658e-08 3.9170717383139e-08 -8.582518964714957e-09 ] [ -7.19539128506034e-09 -1.268611870228528e-08 -4.39286325997512e-08 ] [ 1.437550741809212e-08 -3.629888994747215e-08 1.653350187733493e-08 ] [ 2.849212456129674e-08 7.878584395753429e-09 2.013440379574506e-08 ] [ 2.273153131837074e-08 2.084751146680689e-08 1.680585428117195e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.334088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.815921096129979e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3042125 1.0122704 3.4868917 ] [ 0.6667102 2.1155473 1.293946 ] [ 2.2124865 1.2775453 -0.5441059 ] [ 1.508606 -0.2761574 1.3536707 ] [ 3.0998466 1.6451 1.8112289 ] [ 1.8648634 3.4687234 3.0837575 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3042125e-10 1.0122704e-10 3.4868917e-10 ] [ 6.667102000000001e-11 2.1155473e-10 1.293946e-10 ] [ 2.2124865e-10 1.2775453e-10 -5.441059000000001e-11 ] [ 1.508606e-10 -2.761574e-11 1.3536707e-10 ] [ 3.0998466e-10 1.6451e-10 1.8112289e-10 ] [ 1.8648634e-10 3.4687234e-10 3.0837575e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.34e-05 -2.2e-05 5.9e-06 ] [ -0.0001024 -5.6e-06 -4.4e-06 ] [ 4.29e-05 0.0001033 -6.81e-05 ] [ 1.15e-05 -0.0001262 5.24e-05 ] [ 6.7e-06 -4.29e-05 2.46e-05 ] [ 6.47e-05 9.34e-05 -1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.749093323559999e-14 -3.5247885948e-14 9.452842140600001e-15 ] [ -1.640628873216e-13 -8.972189150399999e-15 -7.0495771896e-15 ] [ 6.873337759859999e-14 1.655048462922e-13 -1.091082287754e-13 ] [ 1.8425031291e-14 -2.021946912108e-13 8.395405562159998e-14 ] [ 1.07345834478e-14 -6.873337759859999e-14 3.94135451964e-14 ] [ 1.036608282198e-13 1.496432976156e-13 -1.6822854657e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.308234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.574173126060435e-18 } }