{ "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" [ [ 1.691051 2.220945 1.919277 ] [ 2.666072 2.808957 4.219459 ] [ 1.090931 4.286689 3.184511 ] [ 3.947256 1.730986 2.765408 ] [ 5.245402 2.932614 3.956238 ] [ 3.932067 4.011287 2.276365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.691051e-10 2.220945e-10 1.919277e-10 ] [ 2.666072e-10 2.808957e-10 4.219459e-10 ] [ 1.090931e-10 4.286689e-10 3.184511e-10 ] [ 3.947256e-10 1.730986e-10 2.765408e-10 ] [ 5.245402000000001e-10 2.932614e-10 3.956238e-10 ] [ 3.932067e-10 4.011287e-10 2.276365e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5313234 -1.425814 -1.612654 ] [ -7.2042895 2.104377 9.5518527 ] [ -0.5792879 2.1994937 -0.0682771 ] [ -1.9271276 -16.6393031 -11.7649894 ] [ 11.0531358 6.0121848 8.9495702 ] [ -0.8111074 7.7490616 -5.0555023 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.512739295639667e-10 -2.284405856409331e-09 -2.583756536239603e-09 ] [ -1.154254420637492e-08 3.371583630749241e-09 1.530375508126536e-08 ] [ -9.281215300923282e-10 3.523977383736889e-09 -1.093919733560237e-10 ] [ -3.087598786018414e-09 -2.665910241322496e-08 -1.884959096063982e-08 ] [ 1.770907576528751e-08 9.632581926489124e-09 1.433879214064838e-08 ] [ -1.299537313237874e-09 1.241536532865904e-08 -8.099807591460627e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.820806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.253031252901237e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.738997 2.368639 2.0288244 ] [ 2.4241302 2.0873541 4.4471593 ] [ 1.4965836 4.7154587 3.3639927 ] [ 4.0760772 1.5389699 2.6121578 ] [ 5.0829735 3.4423273 4.2590884 ] [ 3.7540175 3.838729 1.6100354 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.738997e-10 2.368639e-10 2.0288244e-10 ] [ 2.4241302e-10 2.0873541e-10 4.4471593e-10 ] [ 1.4965836e-10 4.7154587e-10 3.3639927e-10 ] [ 4.0760772e-10 1.5389699e-10 2.6121578e-10 ] [ 5.0829735e-10 3.4423273e-10 4.2590884e-10 ] [ 3.7540175e-10 3.838729e-10 1.6100354e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.08e-05 -4.2e-06 2.25e-05 ] [ 1.64e-05 -5.26e-05 -3.68e-05 ] [ 1.35e-05 2.85e-05 -1.93e-05 ] [ -6.38e-05 5.99e-05 8.2e-06 ] [ 1.23e-05 1.27e-05 7.7e-06 ] [ -2.91e-05 -4.43e-05 1.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.139057233664001e-14 -6.72914180736e-15 3.604897396800001e-14 ] [ 2.627569658112e-14 -8.427449025408001e-14 -5.896009964544001e-14 ] [ 2.16293843808e-14 4.56620336928e-14 -3.092200878144e-14 ] [ -1.0221886840704e-13 9.597037958592001e-14 1.313784829056e-14 ] [ 1.970677243584e-14 2.034764308416e-14 1.233675998016e-14 ] [ -4.662333966527999e-14 -7.097642430144e-14 2.851874385024e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.652045 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.507734056670954e-18 } }