{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.217867 0.582151 1.835859 ] [ 0.6949625 2.323475 0.0682123 ] [ 2.516208 1.946218 1.367291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.17867e-11 5.82151e-11 1.835859e-10 ] [ 6.949625000000001e-11 2.323475e-10 6.82123e-12 ] [ 2.516208e-10 1.946218e-10 1.367291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.154148 2.5272268 -1.3936403 ] [ -0.9575879 -0.6285276 0.2641851 ] [ -2.1965601 -1.8986992 1.1294552 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.053502225777832e-09 4.049063727778591e-09 -2.23285792486075e-09 ] [ -1.534224958381128e-09 -1.007012234544098e-09 4.232711942709534e-10 ] [ -3.519277267396703e-09 -3.042051493234493e-09 1.809586730589797e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.0647462 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.71679465278029e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3841646 0.7052027 1.7740573 ] [ 0.6010813 2.3089092 0.0402102 ] [ 2.4437916 1.8377321 1.4570949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.841646000000001e-11 7.052026999999999e-11 1.7740573e-10 ] [ 6.010813e-11 2.3089092e-10 4.02102e-12 ] [ 2.4437916e-10 1.8377321e-10 1.4570949e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 1e-06 -1.4e-06 ] [ -1.3e-06 -1.2e-06 7e-07 ] [ 2e-06 2e-07 7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.1215236438e-15 1.602176634e-15 -2.2430472876e-15 ] [ -2.0828296242e-15 -1.9226119608e-15 1.1215236438e-15 ] [ 3.204353268e-15 3.204353268e-16 1.1215236438e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.5422083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.048177327302086e-18 } }