{ "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" [ [ 1.769072 1.556883 1.447632 ] [ 2.706705 2.541189 3.648112 ] [ 2.031108 4.136433 1.782649 ] [ 3.490046 0.5483522 2.253956 ] [ 3.629143 2.897596 1.184251 ] [ 4.796562 2.667265 3.117649 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.769072e-10 1.556883e-10 1.447632e-10 ] [ 2.706705e-10 2.541189e-10 3.648112e-10 ] [ 2.031108e-10 4.136433e-10 1.782649e-10 ] [ 3.490046e-10 5.483522e-11 2.253956e-10 ] [ 3.629143e-10 2.897596e-10 1.184251e-10 ] [ 4.796562e-10 2.667265e-10 3.117649e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.3607387 -16.1763169 -12.7117664 ] [ -11.3080094 5.9204968 39.3811357 ] [ -8.619989 18.5713484 -1.7211456 ] [ 4.7609161 -30.5416986 -0.1213264 ] [ 18.8378409 16.7249524 -32.4449948 ] [ 16.6899801 5.5012179 7.6180975 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.262149952735778e-08 -2.591731674783193e-08 -2.036649493515098e-08 ] [ -1.811742828846664e-08 9.485681556481213e-09 6.309553491909225e-08 ] [ -1.381074484735317e-08 2.975458022321149e-08 -2.757579241312789e-09 ] [ 7.627828469010316e-09 -4.893319545644009e-08 -1.943863215658291e-10 ] [ 3.018154827633003e-08 2.679632771927285e-08 -5.198261213053758e-08 ] [ 2.674029591783725e-08 8.813922705306473e-09 1.220553770947493e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.419205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.630646638312247e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4730956 1.2686157 1.350782 ] [ 2.7506376 3.3175362 4.1000456 ] [ 1.826182 3.5886391 1.7948591 ] [ 3.4889683 0.2882318 2.1851286 ] [ 4.2015285 3.6850499 1.0264609 ] [ 4.682224 2.1996454 2.9769727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4730956e-10 1.2686157e-10 1.350782e-10 ] [ 2.7506376e-10 3.3175362e-10 4.1000456e-10 ] [ 1.826182e-10 3.5886391e-10 1.7948591e-10 ] [ 3.4889683e-10 2.882318e-11 2.1851286e-10 ] [ 4.2015285e-10 3.6850499e-10 1.0264609e-10 ] [ 4.682224e-10 2.1996454e-10 2.9769727e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.62e-05 -9.3e-06 -8.4e-06 ] [ -3.3e-06 1.01e-05 3.35e-05 ] [ -3.49e-05 -1.13e-05 -1.39e-05 ] [ -2.91e-05 1.34e-05 9.3e-06 ] [ 1.5e-05 3.32e-05 -2.96e-05 ] [ 3.62e-05 -3.61e-05 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.595526125696e-14 -1.490024257344e-14 -1.345828361472e-14 ] [ -5.28718284864e-15 1.618198387008e-14 5.36729167968e-14 ] [ -5.591596406592e-14 -1.810459581504e-14 -2.227025502912e-14 ] [ -4.662333966527999e-14 2.146916671872e-14 1.490024257344e-14 ] [ 2.4032649312e-14 5.319226381056e-14 -4.742442797568e-14 ] [ 5.799879367296e-14 -5.783857601088001e-14 1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }