{ "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" [ [ 0.0755506 0.3541964 0.6731301 ] [ 0.5631114 0.1579036 2.39025 ] [ 0.1113923 2.692001 2.732528 ] [ 1.634511 1.700059 1.731597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.555059999999999e-12 3.541964e-11 6.731301e-11 ] [ 5.631114000000001e-11 1.579036e-11 2.39025e-10 ] [ 1.113923e-11 2.692001e-10 2.732528e-10 ] [ 1.634511e-10 1.700059e-10 1.731597e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8989467 0.5019763 -19.6225591 ] [ -0.0257333 -8.1823204 21.5158924 ] [ -3.3425787 2.1802381 3.0578542 ] [ 9.2672586 5.500106 -4.9511876 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.451154567951408e-09 8.042546986817742e-10 -3.143880568930407e-08 ] [ -4.122929197571219e-11 -1.310952255678153e-08 3.447226006293818e-08 ] [ -5.355401490446095e-09 3.493126540376555e-09 4.899222549418762e-09 ] [ 1.484778519015555e-08 8.812141317723202e-09 -7.932677083270537e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.4216583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.482100977792161e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3490543 0.1257401 0.3331851 ] [ 0.1787468 0.2838944 2.6961479 ] [ 0.2653431 2.6099716 3.164632 ] [ 1.5914211 1.8845539 1.3335401 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.490543e-11 1.257401e-11 3.331851e-11 ] [ 1.787468e-11 2.838944e-11 2.6961479e-10 ] [ 2.653431e-11 2.6099716e-10 3.164632e-10 ] [ 1.5914211e-10 1.8845539e-10 1.3335401e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -1e-07 -8e-07 ] [ 3e-07 7e-07 5e-07 ] [ 1e-07 -3e-07 -2e-07 ] [ -4e-07 -3e-07 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -1.602176634e-16 -1.2817413072e-15 ] [ 4.806529901999999e-16 1.1215236438e-15 8.010883169999999e-16 ] [ 1.602176634e-16 -4.806529901999999e-16 -3.204353268e-16 ] [ -6.408706536e-16 -4.806529901999999e-16 8.010883169999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.026357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.606399490954234e-18 } }