{ "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" [ [ 0.0587563 2.624587 0.4359975 ] [ 0.6130103 1.606213 2.369845 ] [ 2.872214 1.39186 0.7464612 ] [ 1.941337 0.0175427 2.118778 ] [ 2.055015 2.698548 0.547582 ] [ 2.796139 2.772611 2.055467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.87563e-12 2.624587e-10 4.359975e-11 ] [ 6.130103e-11 1.606213e-10 2.369845e-10 ] [ 2.872214e-10 1.39186e-10 7.464612e-11 ] [ 1.941337e-10 1.75427e-12 2.118778e-10 ] [ 2.055015e-10 2.698548e-10 5.47582e-11 ] [ 2.796139e-10 2.772611e-10 2.055467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9313776 -0.3835812 -0.0183237 ] [ -2.9965717 1.9314528 2.7538754 ] [ 10.2564647 -14.5340873 -4.2393485 ] [ -0.0451159 -4.8903518 1.0283485 ] [ -7.4285342 12.7725424 -11.7948088 ] [ 3.1451347 5.1040251 12.2702571 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.696584696150998e-09 -6.145648358816808e-10 -2.935780398842579e-11 ] [ -4.801037159845658e-09 3.094528545833875e-09 4.412194818827403e-09 ] [ 1.643266808978582e-08 -2.328617506857615e-08 -6.792185110082949e-09 ] [ -7.22836408018806e-11 -7.835207385999841e-09 1.647595938308949e-09 ] [ -1.190182392010988e-08 2.046386899005428e-08 -1.889736706185758e-08 ] [ 5.039061327122599e-09 8.177549754569513e-09 1.96591192187926e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.652539319227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.056366420032738e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.121235 2.6199098 0.63852 ] [ 0.6707997 1.7015745 2.5932759 ] [ 3.3343451 1.1040404 0.8438482 ] [ 1.7852317 -0.2021195 1.9408034 ] [ 2.0477316 3.0085685 -0.0350024 ] [ 2.6195986 2.879388 2.2926855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.21235e-11 2.6199098e-10 6.3852e-11 ] [ 6.707997e-11 1.7015745e-10 2.5932759e-10 ] [ 3.3343451e-10 1.1040404e-10 8.438482000000001e-11 ] [ 1.7852317e-10 -2.021195e-11 1.9408034e-10 ] [ 2.0477316e-10 3.0085685e-10 -3.50024e-12 ] [ 2.6195986e-10 2.879388e-10 2.2926855e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.6e-06 1.22e-05 1.02e-05 ] [ -1.24e-05 -5.4e-06 9.4e-06 ] [ 1.31e-05 -1.06e-05 -1.4e-06 ] [ 5.2e-06 7e-07 -8.8e-06 ] [ 2.7e-06 -9.6e-06 -2.7e-06 ] [ -1.32e-05 1.27e-05 -6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.370012516399999e-15 1.95465549348e-14 1.63422016668e-14 ] [ -1.98669902616e-14 -8.6517538236e-15 1.50604603596e-14 ] [ 2.09885139054e-14 -1.69830723204e-14 -2.2430472876e-15 ] [ 8.331318496799998e-15 1.1215236438e-15 -1.40991543792e-14 ] [ 4.3258769118e-15 -1.53808956864e-14 -4.3258769118e-15 ] [ -2.11487315688e-14 2.03476432518e-14 -1.07345834478e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.065364719227606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.573955196983444e-18 } }