{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5366073e-10 2.5100369e-10 1.9254097e-10 ] [ 1.8914342e-10 2.5588631e-10 4.3557014e-10 ] [ 2.0368929e-10 4.7140369e-10 3.0286881e-10 ] [ 4.9429203e-10 1.9281058e-10 1.2453044e-10 ] [ 4.260366000000001e-10 2.0048019e-10 3.718679e-10 ] [ 4.4059893e-10 4.1627039e-10 2.3898128e-10 ] [ 3.7591591e-10 4.2094154e-10 4.8195526e-10 ] ] "source-value" [ [ 2.5366073 2.5100369 1.9254097 ] [ 1.8914342 2.5588631 4.3557014 ] [ 2.0368929 4.7140369 3.0286881 ] [ 4.9429203 1.9281058 1.2453044 ] [ 4.260366 2.0048019 3.718679 ] [ 4.4059893 4.1627039 2.3898128 ] [ 3.7591591 4.2094154 4.8195526 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.0101723594144e-12 7.04957713152e-15 3.13161442301568e-12 ] [ 1.38396016504704e-12 -2.368497698528641e-12 -1.66498194433536e-12 ] [ 2.35664159153472e-12 5.5483376378304e-13 -1.60682293300032e-12 ] [ -9.6563184935616e-13 2.33341003053312e-12 -1.89649646604096e-12 ] [ -2.17639672169472e-12 2.3728235754048e-12 -7.674426013632e-14 ] [ -1.36297165131456e-12 -4.88231281656384e-12 2.48545659184704e-12 ] [ -2.459341112928e-13 1.98269356824e-12 -3.721856290118401e-13 ] ] "source-value" [ [ 0.0006305 4.4e-06 0.0019546 ] [ 0.0008638 -0.0014783 -0.0010392 ] [ 0.0014709 0.0003463 -0.0010029 ] [ -0.0006027 0.0014564 -0.0011837 ] [ -0.0013584 0.001481 -4.79e-05 ] [ -0.0008507 -0.0030473 0.0015513 ] [ -0.0001535 0.0012375 -0.0002323 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.139682483656322e-18 "source-value" -25.837866 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.417988586013251e-08 -5.095530961912891e-09 5.045755499963849e-09 ] [ -8.592147975496377e-09 -8.400335871107189e-09 -6.06055814981236e-09 ] [ -7.115561493906352e-09 1.14470990202853e-08 -5.175191343716728e-09 ] [ 8.119015285879089e-09 -3.0352712169301e-09 -5.03853657276351e-09 ] [ 6.717058992374236e-09 -9.64584826934467e-09 4.240494320554975e-09 ] [ 3.981939703802471e-09 5.613194708746357e-09 2.54049600508372e-09 ] [ 1.106958134747944e-08 9.116692430045532e-09 4.447540240690055e-09 ] ] "source-value" [ [ -8.8503887 -3.1803803 3.1493129 ] [ -5.362797 -5.2430773 -3.7827029 ] [ -4.4411842 7.1447173 -3.2301004 ] [ 5.0674908 -1.8944673 -3.1448072 ] [ 4.1924585 -6.020465 2.6467084 ] [ 2.4853313 3.5034806 1.5856529 ] [ 6.9090893 5.6901919 2.7759363 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.922923067491038e-18 "source-value" -18.243451 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] "source-value" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] } "instance-id" 1 }