{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 8.6834563 -15.453597 -36.8324587 ] [ -15.9869063 14.3284626 32.3088343 ] [ -0.7171174 1.6854995 1.0861926 ] [ -0.0059502 -0.8206608 -0.2750755 ] [ 8.0265176 0.2602957 3.7125073 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.391243067159847e-08 -2.475939182066502e-08 -5.901210421572156e-08 ] [ -2.561384751278023e-08 2.295672778972719e-08 5.176445896076114e-08 ] [ -1.148948732648882e-09 2.70046789327009e-09 1.740272389405966e-09 ] [ -9.53327132908416e-12 -1.314843547367025e-09 -4.407195350548704e-10 ] [ 1.285989884515973e-08 4.170396850347706e-10 5.948092400609331e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.66209497 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.060793081683277e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.462991 2.217747 -0.1203487 ] [ -0.3861057 3.1278328 1.9364583 ] [ 2.1684246 0.5526454 0.364269 ] [ 2.4532797 0.3556412 2.7432864 ] [ 2.0019856 2.5927871 1.8560206 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.62991e-11 2.217747e-10 -1.203487e-11 ] [ -3.861057e-11 3.1278328e-10 1.9364583e-10 ] [ 2.1684246e-10 5.526454e-11 3.64269e-11 ] [ 2.4532797e-10 3.556412e-11 2.7432864e-10 ] [ 2.0019856e-10 2.5927871e-10 1.8560206e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.37e-05 -1.3e-06 -7.2e-06 ] [ -3.23e-05 1.17e-05 -2.7e-06 ] [ 7.1e-06 -1.29e-05 -5.2e-06 ] [ 4.9e-06 -2.15e-05 3.6e-06 ] [ 3.41e-05 2.4e-05 1.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.194981970496e-14 -2.08282960704e-15 -1.153567166976e-14 ] [ -5.175030485184e-14 1.874546646336e-14 -4.32587687616e-15 ] [ 1.137545400768e-14 -2.066807840832e-14 -8.33131842816e-15 ] [ 7.850665441919999e-15 -3.44467973472e-14 5.76783583488e-15 ] [ 5.463422276928e-14 3.84522388992e-14 1.826481347712e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.808346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.21234091331172e-18 } }