{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8990231 -0.1555128 -0.6547575 ] [ 0.1308943 -0.864357 0.9319189 ] [ 1.1021095 0.8441444 -0.7401311 ] [ -0.5865411 -0.1473308 1.1641125 ] [ 0.0411512 -1.6059668 -4.4456717 ] [ 0.5599515 2.789728 0.6703979 ] [ -0.3485423 -0.8607049 3.074131 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44039379237914e-09 -2.491589723951462e-10 -1.049037158793456e-09 ] [ 2.097157872559814e-10 -1.384852577424826e-09 1.493098674061653e-09 ] [ 1.765774074461578e-09 1.352468422259243e-09 -1.185820744746987e-09 ] [ -9.39742437558315e-10 -2.360499632837606e-10 1.86511383148104e-09 ] [ 6.593149055786496e-11 -2.573042460740989e-09 -7.122751261492192e-09 ] [ 8.971412020818912e-10 4.469636979991143e-09 1.074095842013416e-09 ] [ -5.5842632441986e-10 -1.379001268188002e-09 4.925300817476525e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.403975085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.186247578308987e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0538821 2.9323086 2.0639426 ] [ 3.1721041 1.8819644 2.3952297 ] [ 1.8899044 2.6026367 4.2757862 ] [ 1.6662946 4.7722551 3.3951973 ] [ 3.0359187 4.0024377 1.3864125 ] [ 3.6881082 5.756511 2.777697 ] [ 3.9289486 3.6502764 3.7490768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0538821e-10 2.9323086e-10 2.0639426e-10 ] [ 3.1721041e-10 1.8819644e-10 2.3952297e-10 ] [ 1.8899044e-10 2.6026367e-10 4.2757862e-10 ] [ 1.6662946e-10 4.7722551e-10 3.3951973e-10 ] [ 3.0359187e-10 4.0024377e-10 1.3864125e-10 ] [ 3.6881082e-10 5.756511e-10 2.777697e-10 ] [ 3.9289486e-10 3.6502764e-10 3.7490768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 4.3e-05 1.43e-05 ] [ -8.3e-06 -5.27e-05 1.13e-05 ] [ 1.29e-05 3.9e-06 -5.03e-05 ] [ -1.55e-05 -3.88e-05 -2.05e-05 ] [ -3.35e-05 -4.7e-06 1.85e-05 ] [ 1.42e-05 7.3e-06 6e-06 ] [ 2.57e-05 4.2e-05 2.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.2097947936e-15 6.889359469439999e-14 2.291112567744e-14 ] [ -1.329806595264e-14 -8.443470791616e-14 1.810459581504e-14 ] [ 2.066807840832e-14 6.24848882112e-15 -8.058948402624e-14 ] [ -2.48337376224e-14 -6.216445288704e-14 -3.28446207264e-14 ] [ -5.36729167968e-14 -7.53023011776e-15 2.96402674848e-14 ] [ 2.275090801536e-14 1.169588933184e-14 9.6130597248e-15 ] [ 4.117593915456e-14 6.72914180736e-14 3.316505605055999e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }