{ "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" [ [ -6.7970375 -4.6012501 -8.6287892 ] [ -6.0573826 -3.631253 5.3939937 ] [ -8.0284666 12.3666769 -2.7921013 ] [ 5.4587535 -0.7935511 -2.7180265 ] [ 7.1727982 -8.7764051 4.4555159 ] [ 3.6021106 1.7998651 -1.2461561 ] [ 4.6492244 3.6359173 5.5355635 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.089005457320088e-08 -7.372015336673662e-09 -1.382484432205154e-08 ] [ -9.704996784960719e-09 -5.817908660809862e-09 8.64213059888249e-09 ] [ -1.286302148739367e-08 1.981360060616742e-08 -4.473439425765287e-09 ] [ 8.745887236410173e-09 -1.271409019830123e-09 -4.354758513014851e-09 ] [ 1.149208958175632e-08 -1.406135106588989e-08 7.138523408582671e-09 ] [ 5.77121738885586e-09 2.883701783813854e-09 -1.996562169287307e-09 ] [ 7.448878638532907e-09 5.82538169322226e-09 8.86895042265382e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.928549 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.712252543186722e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4500514 2.4624468 1.82725 ] [ 1.8950538 2.5404351 4.34907 ] [ 2.0376355 4.7127209 3.0271983 ] [ 4.8603736 2.0050651 1.335596 ] [ 4.3329477 1.9033947 3.7793755 ] [ 4.4879748 4.2653446 2.3420885 ] [ 3.7693322 4.1985568 4.8225697 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4500514e-10 2.4624468e-10 1.82725e-10 ] [ 1.8950538e-10 2.5404351e-10 4.34907e-10 ] [ 2.0376355e-10 4.7127209e-10 3.0271983e-10 ] [ 4.8603736e-10 2.0050651e-10 1.335596e-10 ] [ 4.3329477e-10 1.9033947e-10 3.7793755e-10 ] [ 4.4879748e-10 4.2653446e-10 2.3420885e-10 ] [ 3.7693322e-10 4.198556800000001e-10 4.8225697e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-06 3.2e-06 -6.8e-06 ] [ 5.9e-06 -3.6e-06 -1.7e-06 ] [ 7e-07 -1.2e-05 -9e-07 ] [ -3.2e-06 -4e-07 3e-06 ] [ -7.5e-06 -1.1e-06 7e-06 ] [ 5.5e-06 9.8e-06 6.2e-06 ] [ 6.6e-06 4.2e-06 -6.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-14 5.126965186560001e-15 -1.089480102144e-14 ] [ 9.45284206272e-15 -5.76783583488e-15 -2.72370025536e-15 ] [ 1.12152363456e-15 -1.92261194496e-14 -1.44195895872e-15 ] [ -5.126965186560001e-15 -6.408706483200001e-16 4.8065298624e-15 ] [ -1.2016324656e-14 -1.76239428288e-15 1.12152363456e-14 ] [ 8.8119714144e-15 1.570133088384e-14 9.93349504896e-15 ] [ 1.057436569728e-14 6.72914180736e-15 -1.089480102144e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }