{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4741639 -0.1339168 -2.5271378 ] [ -1.5286062 -1.8172373 2.6821977 ] [ 3.0713154 -1.5674878 0.2437908 ] [ 1.1943397 1.1930818 -2.5410875 ] [ -0.262885 2.3255602 2.1422368 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.964047556607349e-09 -2.145583660923494e-10 -4.048921100699946e-09 ] [ -2.449097116049929e-09 -2.911535116505716e-09 4.297354447303533e-09 ] [ 4.920789728983001e-09 -2.511392306549227e-09 3.905959201261287e-10 ] [ 1.913543144633286e-09 1.911527766661982e-09 -4.07127098390712e-09 ] [ -4.21188200959008e-10 3.725958182702972e-09 3.432241717177405e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 10.080916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.615140793144866e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.5406944 0.7332695 -0.3858679 ] [ 0.1048112 -0.888222 4.8298858 ] [ 4.808591 -0.3967048 2.0198413 ] [ 3.8976619 3.8170836 -1.4062026 ] [ 1.9727395 4.2639288 3.727334 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.406944000000001e-11 7.332695e-11 -3.858679e-11 ] [ 1.048112e-11 -8.88222e-11 4.8298858e-10 ] [ 4.808591e-10 -3.967048e-11 2.0198413e-10 ] [ 3.8976619e-10 3.8170836e-10 -1.4062026e-10 ] [ 1.9727395e-10 4.263928800000001e-10 3.727334e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 8.8817842e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.423018699623083e-34 } }