{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0601232 -8.0465048 -4.303086 ] [ -4.2242739 4.940416 6.6238894 ] [ -1.6767774 6.8583815 -5.6295016 ] [ 1.7874286 -0.3482505 -2.3645641 ] [ 4.4912789 -7.8897548 4.1375457 ] [ 0.0178135 -1.1318582 -1.7827184 ] [ -1.455593 5.6175708 3.318435 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.698504606207682e-09 -1.289192186971498e-08 -6.894303786491789e-09 ] [ -6.768032882435637e-09 7.915419012226252e-09 1.061264073544494e-08 ] [ -2.68649354856581e-09 1.098833849582724e-08 -9.019455850276194e-09 ] [ 2.863776314269274e-09 -5.579588092819104e-10 -3.788449319402993e-09 ] [ 7.195822051072341e-09 -1.264078068440458e-08 6.629078988031571e-09 ] [ 2.85403732346208e-11 -1.813436746100771e-09 -2.856229741949983e-09 ] [ -2.332117074000135e-09 9.000340601448753e-09 5.316718974644449e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.551428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.651831098245451e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7124279 1.5081387 2.3368885 ] [ 1.7859951 3.0826795 4.2538357 ] [ 2.0575819 3.9124742 1.8745263 ] [ 5.0909526 2.3779461 2.2394857 ] [ 4.1353863 1.8941286 4.5364991 ] [ 4.3455279 4.7297417 2.3090467 ] [ 3.8948183 4.4108381 4.7145791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7124279e-10 1.5081387e-10 2.3368885e-10 ] [ 1.7859951e-10 3.0826795e-10 4.2538357e-10 ] [ 2.0575819e-10 3.9124742e-10 1.8745263e-10 ] [ 5.0909526e-10 2.3779461e-10 2.2394857e-10 ] [ 4.135386300000001e-10 1.8941286e-10 4.5364991e-10 ] [ 4.3455279e-10 4.7297417e-10 2.3090467e-10 ] [ 3.8948183e-10 4.410838100000001e-10 4.7145791e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 4.66e-05 -2.42e-05 ] [ 5.7e-06 -2.03e-05 1.89e-05 ] [ -2e-06 5.3e-06 2.83e-05 ] [ 2e-05 -9e-06 2.77e-05 ] [ 2.3e-06 3.04e-05 -2.66e-05 ] [ -1.9e-06 -5.76e-05 -9.1e-06 ] [ -2.34e-05 4.5e-06 -1.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 7.466143052928e-14 -3.877267422336e-14 ] [ 9.13240673856e-15 -3.252418540224e-14 3.028113813312e-14 ] [ -3.2043532416e-15 8.491536090240001e-15 4.534159836864e-14 ] [ 3.2043532416e-14 -1.44195895872e-14 4.438029239616e-14 ] [ 3.68500622784e-15 4.870616927232e-14 -4.261789811328e-14 ] [ -3.04413557952e-15 -9.228537335808e-14 -1.457980724928e-14 ] [ -3.749093292672001e-14 7.2097947936e-15 -2.4032649312e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }