{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2834021 -10.0251012 -1.5405264 ] [ -1.9688148 9.5036563 -2.9151014 ] [ -3.5271196 -0.9478232 3.9694071 ] [ 0.5282854 -4.439212 -5.957821 ] [ 3.1493732 -3.0984908 10.0003109 ] [ 0.5348737 9.0069707 -3.5562692 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.056236856646531e-09 -1.606198289612536e-08 -2.468195402140138e-09 ] [ -3.154389069233383e-09 1.522653606142689e-08 -4.670507348820687e-09 ] [ -5.651068608443425e-09 -1.518580184203109e-09 6.359691306453701e-09 ] [ 8.464065239633435e-10 -7.112401739772407e-09 -9.545481595754512e-09 ] [ 5.045852152785808e-09 -4.964329560423967e-09 1.602226445671551e-08 ] [ 8.569621442811257e-10 1.443075799866262e-08 -5.697771416453872e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.8295428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.414648716306293e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4306912 0.2350683 0.063304 ] [ 0.2546934 2.7403476 -0.0360528 ] [ 0.2967004 1.5211988 2.2984765 ] [ 2.6135207 -0.4396505 0.6693513 ] [ 2.8534472 1.1694558 2.3841401 ] [ 2.0047698 3.4152976 1.6403698 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.306912e-11 2.350683e-11 6.3304e-12 ] [ 2.546934e-11 2.7403476e-10 -3.605280000000001e-12 ] [ 2.967004e-11 1.5211988e-10 2.2984765e-10 ] [ 2.6135207e-10 -4.396505e-11 6.693513e-11 ] [ 2.8534472e-10 1.1694558e-10 2.3841401e-10 ] [ 2.0047698e-10 3.4152976e-10 1.6403698e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 7.6e-06 2.15e-05 ] [ 3.7e-06 1.29e-05 -3.08e-05 ] [ -5.5e-06 -1.77e-05 8.7e-06 ] [ -1.45e-05 2.63e-05 8e-06 ] [ 2.06e-05 -2.24e-05 -3.2e-06 ] [ -1.21e-05 -6.6e-06 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.24969777452e-14 1.21765424184e-14 3.4446797631e-14 ] [ 5.9280535458e-15 2.06680785786e-14 -4.93470403272e-14 ] [ -8.811971486999999e-15 -2.83585264218e-14 1.39389367158e-14 ] [ -2.3231561193e-14 4.21372454742e-14 1.2817413072e-14 ] [ 3.300483866039999e-14 -3.588875660159999e-14 -5.1269652288e-15 ] [ -1.93863372714e-14 -1.05743657844e-14 -6.568924199399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.060752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.252780831086877e-18 } }