{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.2789141e-10 1.9824719e-10 1.9178656e-10 ] [ 2.2252911e-10 3.3678789e-10 3.9312456e-10 ] [ 1.2446141e-10 4.0364793e-10 4.25392e-11 ] [ 3.81717e-10 1.7170313e-10 1.7102657e-10 ] [ 3.846249300000001e-10 1.2114125e-10 4.1841048e-10 ] [ 3.3627622e-10 4.232764600000001e-10 1.8077153e-10 ] [ 4.3249872e-10 3.3534504e-10 5.527207899999999e-10 ] ] "source-value" [ [ 1.2789141 1.9824719 1.9178656 ] [ 2.2252911 3.3678789 3.9312456 ] [ 1.2446141 4.0364793 0.425392 ] [ 3.81717 1.7170313 1.7102657 ] [ 3.8462493 1.2114125 4.1841048 ] [ 3.3627622 4.2327646 1.8077153 ] [ 4.3249872 3.3534504 5.5272079 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.4828144625504e-12 -6.397651464516481e-12 -7.1264816093184e-13 ] [ -4.889682829019521e-12 7.35014546558208e-12 -4.6110643146624e-13 ] [ 6.0025547098272e-12 -1.7688029893632e-12 8.04581055433344e-12 ] [ -4.185365986515841e-12 7.057748232286081e-12 2.1004535498688e-13 ] [ 1.65248496669312e-12 -1.0201859632944e-11 -4.64246697643008e-12 ] [ 3.4462819113408e-12 -1.66113672044544e-12 -3.11575287446976e-12 ] [ -5.436185274374401e-13 5.621557109400961e-12 6.761185339776001e-13 ] ] "source-value" [ [ -0.0009255 -0.0039931 -0.0004448 ] [ -0.0030519 0.0045876 -0.0002878 ] [ 0.0037465 -0.001104 0.0050218 ] [ -0.0026123 0.0044051 0.0001311 ] [ 0.0010314 -0.0063675 -0.0028976 ] [ 0.002151 -0.0010368 -0.0019447 ] [ -0.0003393 0.0035087 0.000422 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.691302942177406e-18 "source-value" -23.039301 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.096889226745842e-09 -8.147381983168015e-09 -3.002151662695571e-09 ] [ -4.227820046047878e-08 -1.224045714892527e-08 3.641351368974206e-08 ] [ -3.610508059108379e-09 1.218458844906966e-08 -4.140170666872679e-09 ] [ 3.925630245158482e-09 -1.788255656586981e-08 -5.523772585227308e-09 ] [ 1.186453396229242e-08 -1.594992028244645e-08 2.152746351724443e-09 ] [ 3.395155333847438e-08 2.822146462456276e-08 -3.726913961166111e-08 ] [ 4.24388004019005e-09 1.381426274655946e-08 1.136897464520782e-08 ] ] "source-value" [ [ -5.0536808 -5.0851959 -1.8737957 ] [ -26.3879774 -7.6398925 22.7275278 ] [ -2.2535019 7.605022 -2.5840913 ] [ 2.4501857 -11.161414 -3.4476677 ] [ 7.4052597 -9.9551573 1.3436386 ] [ 21.190893 17.6144529 -23.2615675 ] [ 2.6488216 8.6221847 7.0959559 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.663314238690769e-18 "source-value" -10.381591 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] "source-value" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] } "instance-id" 1 }