{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8539313 -4.6681896 -6.1214868 ] [ 7.5914697 4.3345708 -1.311712 ] [ -2.4055993 -2.7154745 2.2556235 ] [ -6.9184552 -3.3346022 -1.8494942 ] [ 1.6587108 4.135645 2.6644863 ] [ -1.0635695 -1.3104812 0.2856888 ] [ 5.9913748 3.5585317 4.0768944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.776855311901244e-09 -7.479264300201806e-09 -9.807703116299429e-09 ] [ 1.216287537105899e-08 6.944748054178686e-09 -2.101594316937408e-09 ] [ -3.854194989226755e-09 -4.350669794122832e-09 3.613907266801298e-09 ] [ -1.10845872648158e-08 -5.342621728524995e-09 -2.963216391958523e-09 ] [ 2.657547686323447e-09 6.62603378551893e-09 4.268977691473114e-09 ] [ -1.704026201535063e-09 -2.09962235793628e-09 4.577239199554992e-10 ] [ 9.599240710096422e-09 5.701396341088298e-09 6.531904946965449e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.250692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.962777247273073e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2075937 3.1549362 1.3928789 ] [ 2.2352463 1.1024295 2.6177143 ] [ 2.8298657 2.4287632 4.5819927 ] [ 4.4561186 0.2325423 2.5819452 ] [ 5.2017212 2.128871 3.8303994 ] [ 3.9947419 4.6965823 0.6032772 ] [ 3.8755065 4.0948873 3.0269512 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2075937e-10 3.1549362e-10 1.3928789e-10 ] [ 2.2352463e-10 1.1024295e-10 2.6177143e-10 ] [ 2.8298657e-10 2.4287632e-10 4.5819927e-10 ] [ 4.4561186e-10 2.325423e-11 2.5819452e-10 ] [ 5.2017212e-10 2.128871e-10 3.8303994e-10 ] [ 3.9947419e-10 4.696582300000001e-10 6.032772e-11 ] [ 3.8755065e-10 4.0948873e-10 3.0269512e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.000127 -9.84e-05 -0.0002386 ] [ 4.24e-05 8.3e-06 -2.58e-05 ] [ -0.0002636 6.95e-05 6.74e-05 ] [ -4.4e-05 -1.81e-05 4.22e-05 ] [ 0.000351 -0.0001619 -5.67e-05 ] [ -7.32e-05 0.0001269 -0.0005018 ] [ 0.0001145 7.35e-05 0.0007133 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.03476432518e-13 -1.576541807856e-13 -3.822793448724e-13 ] [ 6.79322892816e-14 1.32980660622e-14 -4.133615715719999e-14 ] [ -4.223337607224e-13 1.11351276063e-13 1.079867051316e-13 ] [ -7.049577189599999e-14 -2.899939707539999e-14 6.761185395480001e-14 ] [ 5.62363998534e-13 -2.593923970446e-13 -9.08434151478e-14 ] [ -1.172793296088e-13 2.033162148546e-13 -8.039722349412e-13 ] [ 1.83449224593e-13 1.17759982599e-13 1.1428325930322e-12 ] ] } "relaxed-potential-energy" { "source-value" -17.025699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.727817711531716e-18 } }