{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.30949 2.712734 2.978333 ] [ 0.0672006 1.690783 1.932827 ] [ 2.539316 0.8650755 1.245634 ] [ 2.964133 0.3086468 2.850804 ] [ 2.353048 2.858216 0.4219119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.30949e-10 2.712734e-10 2.978333e-10 ] [ 6.72006e-12 1.690783e-10 1.932827e-10 ] [ 2.539316e-10 8.650755e-11 1.245634e-10 ] [ 2.964133e-10 3.086468e-11 2.850804e-10 ] [ 2.353048e-10 2.858216e-10 4.219119e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.0336576 3.3182289 3.3947109 ] [ -4.0336576 -3.3182289 -3.3947109 ] [ -3.3486289 4.7298515 -12.6763537 ] [ 3.5145489 -5.1831051 13.3194556 ] [ -0.16592 0.4532536 -0.6431019 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.462631903032238e-09 5.316388766042901e-09 5.438926438354928e-09 ] [ -6.462631903032238e-09 -5.316388766042901e-09 -5.438926438354928e-09 ] [ -5.365094935315221e-09 7.57805749315581e-09 -2.030975753513158e-08 ] [ 5.630928080238357e-09 -8.304249814369245e-09 2.134012036410364e-08 ] [ -2.658331449231361e-10 7.261923212134349e-10 -1.03036282897206e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1442608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.242014385057904e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3996033 2.7868644 3.054172 ] [ -0.0229127 1.6166526 1.856988 ] [ 2.5878942 1.2311405 1.3997304 ] [ 3.016549 -0.1307578 3.0742735 ] [ 2.2520537 2.9315556 0.044346 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3996033e-10 2.7868644e-10 3.054172e-10 ] [ -2.29127e-12 1.6166526e-10 1.856988e-10 ] [ 2.5878942e-10 1.2311405e-10 1.3997304e-10 ] [ 3.016549e-10 -1.307578e-11 3.0742735e-10 ] [ 2.2520537e-10 2.9315556e-10 4.4346e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0011249 0.0009254 0.0009467 ] [ -0.0011249 -0.0009254 -0.0009467 ] [ 0.0107581 -0.0271581 0.0415454 ] [ -0.0056028 0.0104448 -0.0213831 ] [ -0.0051553 0.0167133 -0.0201623 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.80228848073792e-12 1.48265424488832e-12 1.51678060691136e-12 ] [ -1.80228848073792e-12 -1.48265424488832e-12 -1.51678060691136e-12 ] [ 1.723637630422848e-11 -4.351207288534848e-11 6.656306858178433e-11 ] [ -8.97667517101824e-12 1.673441436893184e-11 -3.425950290022848e-11 ] [ -8.25970113321024e-12 2.677765851641664e-11 -3.230356568155584e-11 ] ] } "relaxed-potential-energy" { "source-value" -8.5386631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.368044639170765e-18 } }