{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.4009216 -8.0257405 4.6896183 ] [ -5.1736736 4.4188381 -4.9515151 ] [ 1.5095837 -4.4541593 -0.9746341 ] [ 11.1018443 6.1905981 -7.4666663 ] [ -2.8938213 -1.9709834 -3.7396424 ] [ 4.7645617 -5.9046892 5.5309444 ] [ 1.0924268 9.7461362 6.9118951 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.666411342229373e-08 -1.28586537937077e-08 7.513596800735841e-09 ] [ -8.28913888557017e-09 7.079759094920293e-09 -7.933201730758174e-09 ] [ 2.418619711280761e-09 -7.136349895778893e-09 -1.561535968854449e-09 ] [ 1.778711538522174e-08 9.918431544588901e-09 -1.196291818117524e-08 ] [ -4.636412831633064e-09 -3.157863523464895e-09 -5.991567623432402e-09 ] [ 7.633669364099104e-09 -9.460354989330256e-09 8.861549808624684e-09 ] [ 1.750260678895357e-09 1.561503156277256e-08 1.107407673464208e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1362259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.463784753932744e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3052096 0.6586717 3.6510236 ] [ 3.1043788 3.6951307 1.670597 ] [ 5.18548 1.0395892 1.9417977 ] [ 5.6907198 3.3697499 1.6391762 ] [ 2.8160368 1.3303551 1.4081174 ] [ 4.5177813 1.3339014 4.2765782 ] [ 4.4230777 3.6978776 3.8933829 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3052096e-10 6.586717e-11 3.6510236e-10 ] [ 3.1043788e-10 3.6951307e-10 1.670597e-10 ] [ 5.18548e-10 1.0395892e-10 1.9417977e-10 ] [ 5.6907198e-10 3.3697499e-10 1.6391762e-10 ] [ 2.8160368e-10 1.3303551e-10 1.4081174e-10 ] [ 4.517781300000001e-10 1.3339014e-10 4.276578200000001e-10 ] [ 4.4230777e-10 3.6978776e-10 3.893382900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 -1.18e-05 -4.3e-06 ] [ -2.72e-05 1.25e-05 -2.62e-05 ] [ -2.66e-05 7e-07 3.71e-05 ] [ 3.73e-05 1.21e-05 -1.7e-05 ] [ -5e-07 -6.8e-06 7.3e-06 ] [ 1.61e-05 -2.61e-05 -2.14e-05 ] [ 4.5e-06 1.94e-05 2.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 -1.890568412544e-14 -6.889359469440001e-15 ] [ -4.357920408576e-14 2.002720776e-14 -4.197702746496e-14 ] [ -4.261789811328e-14 1.12152363456e-15 5.944075263168e-14 ] [ 5.976118795584e-14 1.938633711168e-14 -2.72370025536e-14 ] [ -8.010883104e-16 -1.089480102144e-14 1.169588933184e-14 ] [ 2.579504359488e-14 -4.181680980288e-14 -3.428657968511999e-14 ] [ 7.2097947936e-15 3.108222644352e-14 3.92533272096e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }