{ "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" [ [ -1.788463954282467e-08 -6.578912168536355e-09 -3.462184728437159e-08 ] [ -5.808055787074525e-08 3.311973250921844e-08 6.927083624201145e-08 ] [ 2.664397135629694e-08 3.921154532986789e-08 -3.522023013624987e-08 ] [ -4.291596708495403e-08 -3.092284713479724e-08 3.533478800862816e-08 ] [ 5.554112232544497e-08 -7.93804121870647e-08 -3.387222104107333e-08 ] [ 3.669607081678205e-08 4.45508934910943e-08 -8.91325788944821e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 0.64546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.03414093018164e-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" [ [ -1.21765424184e-14 -6.745163629139998e-14 4.486094575199999e-14 ] [ -6.18440180724e-14 -5.2871828922e-15 -5.6877270507e-14 ] [ 1.89056842812e-14 7.24183838568e-14 8.1711008334e-15 ] [ -4.53415987422e-14 -1.8425031291e-14 4.053506884019999e-14 ] [ 2.62756967976e-14 7.850665506599998e-15 -2.46735201636e-14 ] [ 7.41807781542e-14 1.08948011112e-14 -1.21765424184e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.436977 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.274364701899541e-18 } }