{ "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" [ [ 2.683716 2.607351 2.520111 ] [ 4.637842 1.301932 1.847927 ] [ 5.191502 3.374533 2.444496 ] [ 3.483741 4.863871 2.209214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.683716e-10 2.607351e-10 2.520111e-10 ] [ 4.637842e-10 1.301932e-10 1.847927e-10 ] [ 5.191502e-10 3.374533e-10 2.444496e-10 ] [ 3.483741e-10 4.863871e-10 2.209214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4017776 0.2963148 -0.3222779 ] [ -1.1027466 -1.3305915 -0.2730957 ] [ 0.7302866 0.8489651 0.6226805 ] [ -1.0293176 0.1853116 -0.0273069 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.245895316784598e-09 4.747486488683831e-10 -5.163461210345886e-10 ] [ -1.766794835742944e-09 -2.13184261069901e-09 -4.375475493858738e-10 ] [ 1.170048126643304e-09 1.360192046301473e-09 9.976441475474367e-10 ] [ -1.649148607684958e-09 2.969019155291543e-10 -4.375047712697459e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -10.284769 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.647801657788755e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8277648 2.635422 2.5470257 ] [ 4.5710783 1.2288455 1.7864391 ] [ 5.1910567 3.3874678 2.5294571 ] [ 3.4069012 4.8959518 2.1588261 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8277648e-10 2.635422e-10 2.5470257e-10 ] [ 4.5710783e-10 1.2288455e-10 1.7864391e-10 ] [ 5.1910567e-10 3.3874678e-10 2.5294571e-10 ] [ 3.4069012e-10 4.8959518e-10 2.1588261e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.62e-05 -3.4e-06 7.4e-06 ] [ 4.1e-06 2e-05 -1.5e-06 ] [ -6.2e-06 3.2e-06 -2.3e-06 ] [ 1.84e-05 -1.98e-05 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.59552614708e-14 -5.4474005556e-15 1.18561070916e-14 ] [ 6.568924199399999e-15 3.204353268e-14 -2.403264951e-15 ] [ -9.9334951308e-15 5.1269652288e-15 -3.685006258199999e-15 ] [ 2.94800500656e-14 -3.17230973532e-14 -5.607618218999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.547071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689827071333901e-18 } }