{ "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" [ [ 0.2100786 2.6915 2.714596 ] [ 1.703066 0.0721581 0.1101228 ] [ 2.026091 1.413329 2.796162 ] [ 1.827772 0.0799437 1.500255 ] [ 2.628484 2.60871 0.5510999 ] [ 1.843839 2.957574 1.991142 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.100786e-11 2.6915e-10 2.714596e-10 ] [ 1.703066e-10 7.215810000000001e-12 1.101228e-11 ] [ 2.026091e-10 1.413329e-10 2.796162e-10 ] [ 1.827772e-10 7.99437e-12 1.500255e-10 ] [ 2.628484e-10 2.60871e-10 5.510999e-11 ] [ 1.843839e-10 2.957574e-10 1.991142e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.0241518 -0.5342246 3.8566148 ] [ -3.1485882 1.5450029 -41.006343 ] [ 3.904264 -5.1708704 10.9785707 ] [ 3.07007 -6.5123336 34.8560991 ] [ 6.4311596 -6.2532385 -13.497485 ] [ 0.7672465 16.9256642 4.8125434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.766263827811024e-08 -8.559221643762318e-10 6.178978067991268e-09 ] [ -5.044594402566754e-09 2.475367525448201e-09 -6.569940405910574e-08 ] [ 6.255320502231091e-09 -8.284647664066744e-09 1.758960930533989e-08 ] [ 4.918794378219455e-09 -1.04339086407703e-08 5.584562707030792e-08 ] [ 1.030385355575348e-08 -1.001879252898646e-08 -2.162535490659869e-08 ] [ 1.229264404690627e-09 2.711790347275153e-08 7.710544522065343e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.1258232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.803767610194242e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0239188 2.4351456 2.7025157 ] [ 1.2837965 0.6727094 -0.31678 ] [ 2.1362939 1.6168606 3.0860789 ] [ 2.0886344 -0.2484295 1.6318529 ] [ 3.0072387 1.7913899 0.8063981 ] [ 1.7472859 3.5555388 1.753312 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.39188e-12 2.4351456e-10 2.7025157e-10 ] [ 1.2837965e-10 6.727094e-11 -3.1678e-11 ] [ 2.1362939e-10 1.6168606e-10 3.0860789e-10 ] [ 2.0886344e-10 -2.484295e-11 1.6318529e-10 ] [ 3.0072387e-10 1.7913899e-10 8.063981e-11 ] [ 1.7472859e-10 3.5555388e-10 1.753312e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.96e-05 1.93e-05 1.44e-05 ] [ -3.8e-06 1.5e-06 -4.3e-06 ] [ -1.31e-05 -6.1e-06 -4.5e-06 ] [ 2.16e-05 1.63e-05 4.2e-06 ] [ 7.7e-06 -4.7e-06 -1.16e-05 ] [ 7.2e-06 -2.64e-05 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.140266176767999e-14 3.092200878144e-14 2.307134333952e-14 ] [ -6.08827115904e-15 2.4032649312e-15 -6.889359469440001e-15 ] [ -2.098851373248e-14 -9.77327738688e-15 -7.2097947936e-15 ] [ 3.460701500928e-14 2.611547891904e-14 6.72914180736e-15 ] [ 1.233675998016e-14 -7.53023011776e-15 -1.858524880128e-14 ] [ 1.153567166976e-14 -4.229746278912e-14 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.243242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.884195554479664e-18 } }