{ "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" [ [ -4.3112345 -3.5833454 1.0250229 ] [ -1.861979 3.4404937 0.8027338 ] [ 3.2671427 -1.4738984 -1.4348184 ] [ -2.3802911 -2.6999077 -4.7249988 ] [ 1.3000756 -2.5369307 1.5076152 ] [ 1.5579841 5.1266464 -1.7281492 ] [ 2.4283022 1.7269421 4.5525946 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.907359122686378e-09 -5.741152224131224e-09 1.642267726164616e-09 ] [ -2.983219222220563e-09 5.512278570149689e-09 1.286121327085943e-09 ] [ 5.234539650757388e-09 -2.361445557914527e-09 -2.298832495573663e-09 ] [ -3.813646751118315e-09 -4.3257289952579e-09 -7.570282610668054e-09 ] [ 2.082950731592532e-09 -4.064611056129779e-09 2.415465826602716e-09 ] [ 2.496165700598129e-09 8.213793005188486e-09 -2.768800245494224e-09 ] [ 3.890569013077206e-09 2.766866258095256e-09 7.294060632100327e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.104346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.4199830033674e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8208883 3.1008549 2.3064494 ] [ 3.2790482 4.6717365 3.3076344 ] [ 5.41183 2.777599 1.3157533 ] [ 3.2982827 1.7887631 0.9266609 ] [ 6.0316468 2.1492528 3.5105828 ] [ 4.8544183 5.0598543 1.5870138 ] [ 4.5542585 3.4613495 4.8903774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8208883e-10 3.1008549e-10 2.3064494e-10 ] [ 3.2790482e-10 4.6717365e-10 3.3076344e-10 ] [ 5.41183e-10 2.777599e-10 1.3157533e-10 ] [ 3.2982827e-10 1.7887631e-10 9.266609e-11 ] [ 6.0316468e-10 2.1492528e-10 3.5105828e-10 ] [ 4.8544183e-10 5.059854299999999e-10 1.5870138e-10 ] [ 4.554258500000001e-10 3.4613495e-10 4.890377400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.24e-05 7.9e-06 8.4e-06 ] [ 6.7e-06 -7.8e-06 3.5e-06 ] [ 2.04e-05 1.35e-05 -1.07e-05 ] [ 9e-06 3.1e-05 4.4e-06 ] [ 6.1e-06 1.73e-05 1.67e-05 ] [ -6.8e-06 -4.86e-05 -1.38e-05 ] [ -3.1e-06 -1.34e-05 -8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.191052251392001e-14 1.265719530432e-14 1.345828361472e-14 ] [ 1.073458335936e-14 -1.249697764224e-14 5.6076181728e-15 ] [ 3.268440306432e-14 2.16293843808e-14 -1.714328984256e-14 ] [ 1.44195895872e-14 4.96674752448e-14 7.04957713152e-15 ] [ 9.77327738688e-15 2.771765553984e-14 2.675634956736e-14 ] [ -1.089480102144e-14 -7.786578377088e-14 -2.211003736704e-14 ] [ -4.96674752448e-15 -2.146916671872e-14 -1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }