{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5039425 0.308667 0.1790965 ] [ 1.2881286 0.1093753 0.1256866 ] [ 0.2379079 0.2301843 -0.6251145 ] [ 1.8030988 -1.9133552 -2.370835 ] [ -0.9888455 -0.3776663 1.5023052 ] [ -0.8403801 0.6821364 -0.1876093 ] [ 0.0040328 0.9606585 1.3764703 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.409581532379545e-09 4.94539055086878e-10 2.869442275311809e-10 ] [ 2.063809544507132e-09 1.752385499967402e-10 2.013721337269044e-10 ] [ 3.811704784240086e-10 3.687959069736462e-10 -1.001543845474593e-09 ] [ 2.888882766153439e-09 -3.065532993982397e-09 -3.79849644006939e-09 ] [ -1.584305154736047e-09 -6.050881213092342e-10 2.406958288576696e-09 ] [ -1.346437359898583e-09 1.092903001280878e-09 -3.005832367810961e-10 ] [ 6.461257929595199e-12 1.539144601953489e-09 2.20534855205497e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.974898 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.879896157413333e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1296268 3.0105553 0.9001954 ] [ 1.44434 2.699079 2.5545256 ] [ 2.322077 4.5213336 3.8333663 ] [ 4.6812068 2.0227669 2.4137634 ] [ 3.111666 2.236244 4.2074869 ] [ 3.6129751 5.1142405 1.9076157 ] [ 4.7146294 4.0214337 3.7293208 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1296268e-10 3.0105553e-10 9.001954e-11 ] [ 1.44434e-10 2.699079e-10 2.5545256e-10 ] [ 2.322077e-10 4.5213336e-10 3.8333663e-10 ] [ 4.681206800000001e-10 2.0227669e-10 2.4137634e-10 ] [ 3.111666e-10 2.236244e-10 4.2074869e-10 ] [ 3.6129751e-10 5.1142405e-10 1.9076157e-10 ] [ 4.7146294e-10 4.0214337e-10 3.7293208e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.6e-06 5.6e-06 2.49e-05 ] [ 1.62e-05 -3.5e-06 -4.9e-06 ] [ 4.5e-06 -9.7e-06 -9.2e-06 ] [ -1.78e-05 1.61e-05 1.4e-06 ] [ -1.1e-06 7.8e-06 -8.1e-06 ] [ 4.7e-06 -1.31e-05 4.9e-06 ] [ -2.8e-06 -3.2e-06 -9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.767835882399999e-15 8.972189150399999e-15 3.989419818659999e-14 ] [ 2.59552614708e-14 -5.607618218999999e-15 -7.850665506599998e-15 ] [ 7.209794853e-15 -1.55411133498e-14 -1.47400250328e-14 ] [ -2.851874408519999e-14 2.579504380739999e-14 2.2430472876e-15 ] [ -1.7623942974e-15 1.24969777452e-14 -1.29776307354e-14 ] [ 7.530230179799999e-15 -2.09885139054e-14 7.850665506599998e-15 ] [ -4.486094575199999e-15 -5.1269652288e-15 -1.45798073694e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319343288959e-18 } }