{ "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" [ [ 0.2973138 0.0992835 1.535424 ] [ 0.4571454 2.256303 0.112609 ] [ 1.021874 2.429871 2.604005 ] [ 1.808416 0.4621254 0.960442 ] [ 2.7331 1.011411 2.670813 ] [ 2.623171 2.959224 2.230467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.973138000000001e-11 9.92835e-12 1.535424e-10 ] [ 4.571454e-11 2.256303e-10 1.12609e-11 ] [ 1.021874e-10 2.429871e-10 2.604005e-10 ] [ 1.808416e-10 4.621254e-11 9.60442e-11 ] [ 2.7331e-10 1.011411e-10 2.670813e-10 ] [ 2.623171e-10 2.959224e-10 2.230467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.4876736 -4.4969998 8.2586966 ] [ 0.4131648 -0.2916378 1.3040955 ] [ -18.0956624 -4.6661551 3.0243557 ] [ 19.7669604 3.8842794 -12.278493 ] [ 3.3606089 -5.1131802 4.9840668 ] [ 16.042602 10.6836935 -5.2927216 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.442704827730137e-08 -7.204987943302277e-09 1.323189061080045e-08 ] [ 6.619629830975078e-10 -4.672552649015463e-10 2.089391321390487e-09 ] [ -2.899244723516962e-08 -7.476004610246687e-09 4.845551995523219e-09 ] [ 3.167016181715941e-08 6.223301643335052e-09 -1.967231442325645e-08 ] [ 5.384289011232405e-09 -8.192217774377468e-09 7.985355303465469e-09 ] [ 2.570308186119932e-08 1.711716394949292e-08 -8.47987480792317e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7433708 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.201894420345392e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3247218 0.2833129 1.7519072 ] [ 0.5959098 2.3023297 0.4420767 ] [ 0.6099188 2.4172594 2.8612142 ] [ 2.3704214 0.6554802 0.5100386 ] [ 2.3844307 0.7704091 2.9291776 ] [ 2.6556177 2.7894265 1.6193457 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.247218e-11 2.833129e-11 1.7519072e-10 ] [ 5.959098000000001e-11 2.3023297e-10 4.420767e-11 ] [ 6.099188e-11 2.4172594e-10 2.8612142e-10 ] [ 2.3704214e-10 6.554802e-11 5.100386e-11 ] [ 2.3844307e-10 7.704091e-11 2.9291776e-10 ] [ 2.6556177e-10 2.7894265e-10 1.6193457e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.1e-06 2.5e-06 -1.3e-06 ] [ -1.8e-06 -1.5e-06 4.4e-06 ] [ 5.6e-06 -4.4e-06 -8.4e-06 ] [ -5.8e-06 1.8e-06 1.46e-05 ] [ -4.2e-06 5.2e-06 -1.41e-05 ] [ 1e-07 -3.5e-06 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.77327738688e-15 4.005441552e-15 -2.08282960704e-15 ] [ -2.88391791744e-15 -2.4032649312e-15 7.04957713152e-15 ] [ 8.972189076479999e-15 -7.04957713152e-15 -1.345828361472e-14 ] [ -9.292624400640001e-15 2.88391791744e-15 2.339177866368e-14 ] [ -6.72914180736e-15 8.33131842816e-15 -2.259069035328e-14 ] [ 1.6021766208e-16 -5.6076181728e-15 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.290227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.770199746772493e-18 } }