{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.095423 1.998262 0.8352723 ] [ 3.003915 2.107064 3.861401 ] [ 2.921301 4.877628 0.9226955 ] [ 1.839297 3.508607 2.236053 ] [ 4.200263 0.9739816 2.537715 ] [ 4.333089 3.298954 2.357847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.095423e-10 1.998262e-10 8.352723e-11 ] [ 3.003915e-10 2.107064e-10 3.861401e-10 ] [ 2.921301e-10 4.877627999999999e-10 9.226955000000001e-11 ] [ 1.839297e-10 3.508607e-10 2.236053e-10 ] [ 4.200263e-10 9.739816e-11 2.537715e-10 ] [ 4.333089e-10 3.298954000000001e-10 2.357847e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.162714 -4.106234 -21.6092574 ] [ -36.2510329 20.6717111 43.2354553 ] [ 16.6298589 24.4739216 -21.9827386 ] [ -26.7860398 -19.3005231 22.05424 ] [ 34.6660419 -49.5453563 -21.1413775 ] [ 22.9038859 27.8064806 -0.5563218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.788463939547685e-08 -6.578912114334066e-09 -3.462184699912939e-08 ] [ -5.808055739223163e-08 3.311973223635185e-08 6.927083567130345e-08 ] [ 2.664397113678281e-08 3.921154500681213e-08 -3.522022984607772e-08 ] [ -4.291596673137832e-08 -3.092284688003034e-08 3.533478771751219e-08 ] [ 5.554112186785322e-08 -7.938041153306599e-08 -3.387222076200716e-08 ] [ 3.669607051445077e-08 4.455089312404876e-08 -8.913257816013735e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 0.64546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.034140921661568e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.0128338 1.5638311 0.5851536 ] [ 2.9726338 2.4734124 4.06506 ] [ 2.977457 5.4111996 1.4380621 ] [ 1.6487689 3.2728999 1.9817343 ] [ 4.279731 0.6809618 2.6896138 ] [ 4.5018635 3.3621919 1.99136 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0128338e-10 1.5638311e-10 5.851536e-11 ] [ 2.9726338e-10 2.4734124e-10 4.06506e-10 ] [ 2.977457e-10 5.4111996e-10 1.4380621e-10 ] [ 1.6487689e-10 3.2728999e-10 1.9817343e-10 ] [ 4.279731e-10 6.809618e-11 2.6896138e-10 ] [ 4.5018635e-10 3.3621919e-10 1.99136e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 -4.21e-05 2.8e-05 ] [ -3.86e-05 -3.3e-06 -3.55e-05 ] [ 1.18e-05 4.52e-05 5.1e-06 ] [ -2.83e-05 -1.15e-05 2.53e-05 ] [ 1.64e-05 4.9e-06 -1.54e-05 ] [ 4.63e-05 6.8e-06 -7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.217654231808e-14 -6.745163573568001e-14 4.48609453824e-14 ] [ -6.184401756288e-14 -5.28718284864e-15 -5.68772700384e-14 ] [ 1.890568412544e-14 7.241838326016e-14 8.17110076608e-15 ] [ -4.534159836864e-14 -1.84250311392e-14 4.053506850624e-14 ] [ 2.627569658112e-14 7.850665441919999e-15 -2.467351996032e-14 ] [ 7.418077754303999e-14 1.089480102144e-14 -1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.436977 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.274364674922732e-18 } }