{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.899503e-11 2.3570517e-10 1.3146227e-10 ] [ 2.1417508e-10 9.699032e-11 3.095309e-11 ] [ 2.6337431e-10 2.1373117e-10 2.3239954e-10 ] ] "source-value" [ [ 0.4899503 2.3570517 1.3146227 ] [ 2.1417508 0.9699032 0.3095309 ] [ 2.6337431 2.1373117 2.3239954 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.22742750919488e-12 6.455169605203199e-13 1.8280835243328e-13 ] [ 5.84794466592e-13 -8.7687126456384e-13 -9.204504686496002e-13 ] [ 6.426330426028799e-13 2.3135430404352e-13 7.3764211621632e-13 ] ] "source-value" [ [ -0.0007661 0.0004029 0.0001141 ] [ 0.000365 -0.0005473 -0.0005745 ] [ 0.0004011 0.0001444 0.0004604 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.051419371123859e-18 "source-value" -6.5624436 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.191349976145587e-10 -1.210050301565683e-10 2.10053365869984e-11 ] [ -1.191083734728653e-10 5.240873535592397e-10 6.932688733972915e-10 ] [ -2.000266241416934e-10 -4.030823234026714e-10 -7.1427420998429e-10 ] ] "source-value" [ [ 0.1991884 -0.0755254 0.0131105 ] [ -0.0743416 0.3271096 0.4327044 ] [ -0.1248468 -0.2515842 -0.4458149 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -7.357123265200989e-19 "source-value" -4.5919552 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.050081e-11 2.714754e-10 1.661353e-10 ] [ 2.62684e-10 6.741337e-11 1.77734e-11 ] [ 2.433596e-10 2.075379e-10 2.109062e-10 ] ] "source-value" [ [ 0.2050081 2.714754 1.661353 ] [ 2.62684 0.6741337 0.177734 ] [ 2.433596 2.075379 2.109062 ] ] } "instance-id" 1 }