{ "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" [ [ 2.743053 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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8199147 -4.452701 -6.6257245 ] [ -5.1127502 -3.9224618 3.7517282 ] [ -8.0266007 11.2892308 -3.6286813 ] [ 5.1477801 -1.3538547 -1.8273817 ] [ 5.7491569 -7.603419 3.5590036 ] [ 3.4069561 2.7926006 -1.3319914 ] [ 5.6553724 3.2506051 6.103047 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.092670788819025e-08 -7.134013441612781e-09 -1.061558088976177e-08 ] [ -8.191528838430524e-09 -6.284476591941085e-09 6.010931209636066e-09 ] [ -1.286003198603691e-08 1.808734165457528e-08 -5.813788343194152e-09 ] [ 8.247652925239486e-09 -2.169114348300198e-09 -2.927788237017759e-09 ] [ 9.211164774491002e-09 -1.218202015994651e-08 5.702152361263035e-09 ] [ 5.458545411511946e-09 4.474239392552053e-09 -2.134085480186661e-09 ] [ 9.060905441197587e-09 5.208043494673246e-09 9.778159219043578e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0668829 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.452674780591131e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3220836 2.1754504 1.9423298 ] [ 1.7101451 2.5420388 4.4487085 ] [ 2.3834104 4.5979069 2.9245271 ] [ 4.8324071 2.2473878 1.3766745 ] [ 4.1845885 1.835804 3.8103571 ] [ 4.6553419 4.6320685 1.9149803 ] [ 3.7453925 4.0573076 5.0655707 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3220836e-10 2.1754504e-10 1.9423298e-10 ] [ 1.7101451e-10 2.5420388e-10 4.4487085e-10 ] [ 2.3834104e-10 4.5979069e-10 2.9245271e-10 ] [ 4.8324071e-10 2.2473878e-10 1.3766745e-10 ] [ 4.1845885e-10 1.835804e-10 3.8103571e-10 ] [ 4.6553419e-10 4.6320685e-10 1.9149803e-10 ] [ 3.7453925e-10 4.0573076e-10 5.0655707e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-06 -1.02e-05 1.09e-05 ] [ -2e-06 -1.11e-05 -7e-06 ] [ -6.1e-06 1.44e-05 7.6e-06 ] [ 1.6e-06 -6.3e-06 3.1e-06 ] [ -7.1e-06 -2.9e-06 -1.7e-06 ] [ 7.9e-06 1.21e-05 7.4e-06 ] [ 7.4e-06 3.9e-06 -2.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-15 -1.634220153216e-14 1.746372516672e-14 ] [ -3.2043532416e-15 -1.778416049088e-14 -1.12152363456e-14 ] [ -9.77327738688e-15 2.307134333952e-14 1.217654231808e-14 ] [ 2.56348259328e-15 -1.009371271104e-14 4.96674752448e-15 ] [ -1.137545400768e-14 -4.646312200320001e-15 -2.72370025536e-15 ] [ 1.265719530432e-14 1.938633711168e-14 1.185610699392e-14 ] [ 1.185610699392e-14 6.24848882112e-15 -3.28446207264e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.134371 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.745228862831352e-18 } }