{ "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" [ [ 1.724599 2.153048 2.374712 ] [ 0.8645185 3.613019 0.4039649 ] [ 2.279761 4.306527 2.243044 ] [ 4.11856 1.980977 2.568835 ] [ 3.209467 2.952847 0.6643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724599e-10 2.153048e-10 2.374712e-10 ] [ 8.645185e-11 3.613019e-10 4.039649e-11 ] [ 2.279761e-10 4.306527e-10 2.243044e-10 ] [ 4.118560000000001e-10 1.980977e-10 2.568835e-10 ] [ 3.209467e-10 2.952847e-10 6.643367000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2817987 -0.8823167 0.0318855 ] [ 0.4962689 -0.2581482 0.5698156 ] [ -0.0249231 1.1393615 0.2332731 ] [ -0.4735615 0.1356413 0.052767 ] [ 0.2840144 -0.1345379 -0.8877413 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.514912926315758e-10 -1.413627200527987e-09 5.108620306340699e-11 ] [ 7.951104357608825e-10 -4.135990141491588e-10 9.129452400086903e-10 ] [ -3.993120846684539e-11 1.825458372979191e-09 3.737447101607454e-10 ] [ -7.587291700619909e-10 2.173213214653842e-10 8.4542054446278e-11 ] [ 4.550412353995296e-10 -2.155534797674285e-10 -1.422318367896784e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.533852 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.008144480841417e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3574627 2.1163376 2.6710408 ] [ 1.1082716 3.2613 0.5763881 ] [ 2.4952626 4.1876102 2.2927986 ] [ 3.7425529 2.1480997 2.4046574 ] [ 3.4933557 3.2930704 0.3100076 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3574627e-10 2.1163376e-10 2.6710408e-10 ] [ 1.1082716e-10 3.2613e-10 5.763881e-11 ] [ 2.495262600000001e-10 4.1876102e-10 2.2927986e-10 ] [ 3.7425529e-10 2.1480997e-10 2.4046574e-10 ] [ 3.4933557e-10 3.2930704e-10 3.100076e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-05 -6e-06 -1.18e-05 ] [ 8.8e-06 -3e-06 1.52e-05 ] [ 4.5e-06 6.8e-06 -7.5e-06 ] [ -3.26e-05 1.29e-05 -1.64e-05 ] [ -1.7e-06 -1.07e-05 2.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.364570931399999e-14 -9.613059803999999e-15 -1.89056842812e-14 ] [ 1.40991543792e-14 -4.806529901999999e-15 2.43530848368e-14 ] [ 7.209794853e-15 1.08948011112e-14 -1.2016324755e-14 ] [ -5.22309582684e-14 2.06680785786e-14 -2.62756967976e-14 ] [ -2.7237002778e-15 -1.71432899838e-14 3.300483866039999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }