{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.9088826 -12.0271737 3.0453527 ] [ -12.4542104 15.0113606 2.9260576 ] [ 13.6532717 -4.8886944 -4.1527237 ] [ -11.1915217 -10.9426604 -19.4264441 ] [ 7.9287947 -12.4312218 6.3174249 ] [ 7.3163919 19.6408277 -8.0863927 ] [ 14.6561564 5.637562 19.3767252 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.189754624797191e-08 -1.926965651644064e-08 4.879192898030157e-09 ] [ -1.995384473340421e-08 2.405085099971826e-08 4.688061077834159e-09 ] [ 2.187495271517027e-08 -7.832551873915884e-09 -6.653396824782073e-09 ] [ -1.793079441891587e-08 -1.753207466223397e-08 -3.11245945622981e-08 ] [ 1.270332949946295e-08 -1.991701293593929e-08 1.012163047843978e-08 ] [ 1.172215205079049e-08 3.146807495410103e-08 -1.295582933054779e-08 ] [ 2.34817511348683e-08 9.03237003471049e-09 3.10449361031062e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.089878 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.135923677592426e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8471446 3.0690491 2.3214099 ] [ 3.2636674 4.6818563 3.3143526 ] [ 5.4218017 2.782305 1.2970965 ] [ 3.302089 1.7884332 0.9614372 ] [ 6.0203428 2.1769596 3.5036602 ] [ 4.8299293 5.0532275 1.5828837 ] [ 4.5653982 3.4575792 4.863632 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8471446e-10 3.0690491e-10 2.3214099e-10 ] [ 3.2636674e-10 4.6818563e-10 3.3143526e-10 ] [ 5.4218017e-10 2.782305e-10 1.2970965e-10 ] [ 3.302089e-10 1.7884332e-10 9.614372e-11 ] [ 6.0203428e-10 2.1769596e-10 3.5036602e-10 ] [ 4.8299293e-10 5.0532275e-10 1.5828837e-10 ] [ 4.5653982e-10 3.4575792e-10 4.863632000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-06 3.4e-06 1.13e-05 ] [ 9.9e-06 7e-06 4e-06 ] [ -2.11e-05 6e-07 -1.18e-05 ] [ 2.9e-05 -6.1e-06 2.6e-06 ] [ -8.9e-06 -1.5e-06 3.4e-06 ] [ -5e-07 3e-07 2.2e-06 ] [ -1e-05 -3.7e-06 -1.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.56348259328e-15 5.44740051072e-15 1.810459581504e-14 ] [ 1.586154854592e-14 1.12152363456e-14 6.4087064832e-15 ] [ -3.380592669888e-14 9.6130597248e-16 -1.890568412544e-14 ] [ 4.64631220032e-14 -9.77327738688e-15 4.16565921408e-15 ] [ -1.425937192512e-14 -2.4032649312e-15 5.44740051072e-15 ] [ -8.010883104e-16 4.8065298624e-16 3.52478856576e-15 ] [ -1.6021766208e-14 -5.928053496960001e-15 -1.874546646336e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }