{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0449884 -1.2612836 -3.2294763 ] [ 0.1804696 0.6809213 -0.1834766 ] [ -3.0663498 3.3264147 0.3795893 ] [ -0.9419917 -3.8560542 -0.674552 ] [ 3.2303835 1.1395089 0.0042041 ] [ 2.4376815 0.6761109 1.3526305 ] [ -0.7952046 -0.7056181 2.351081 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.674255983487199e-09 -2.020799096118459e-09 -5.174191425287687e-09 ] [ 2.891441738851277e-10 1.090956187464743e-09 -2.939619189838732e-10 ] [ -4.912833960754756e-09 5.329503863425446e-09 6.081691019658375e-10 ] [ -1.509237078727647e-09 -6.178079887777648e-09 -1.080751443913882e-09 ] [ 5.175644919918077e-09 1.825694518773525e-09 6.735710731505279e-12 ] [ 3.905596308256675e-09 1.083249077048047e-09 2.167152963681014e-09 ] [ -1.274058218872616e-09 -1.130524823033316e-09 3.766847011807085e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.665032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.631338438008387e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5168633 1.458524 1.0389357 ] [ 2.2086488 1.2811394 3.5779217 ] [ 2.3514631 3.5160396 2.3298247 ] [ 3.9356193 -0.090112 2.2701941 ] [ 4.6389507 2.3723648 2.150041 ] [ 4.6470565 1.010297 4.3220462 ] [ 3.6679893 3.2390219 4.3588996 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5168633e-10 1.458524e-10 1.0389357e-10 ] [ 2.2086488e-10 1.2811394e-10 3.5779217e-10 ] [ 2.3514631e-10 3.5160396e-10 2.3298247e-10 ] [ 3.9356193e-10 -9.0112e-12 2.2701941e-10 ] [ 4.6389507e-10 2.3723648e-10 2.150041e-10 ] [ 4.6470565e-10 1.010297e-10 4.3220462e-10 ] [ 3.6679893e-10 3.2390219e-10 4.3588996e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.15e-05 -1.57e-05 1.95e-05 ] [ 2.41e-05 2.52e-05 -3.35e-05 ] [ 5.1e-06 -1.58e-05 1e-05 ] [ -1.03e-05 1.29e-05 6.4e-06 ] [ -4.53e-05 1.18e-05 1.07e-05 ] [ -1.81e-05 1.3e-05 -3.7e-06 ] [ 2.3e-05 -3.13e-05 -9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.44467973472e-14 -2.515417294656e-14 3.12424441056e-14 ] [ 3.861245656128e-14 4.037485084416e-14 -5.36729167968e-14 ] [ 8.17110076608e-15 -2.531439060864e-14 1.6021766208e-14 ] [ -1.650241919424e-14 2.066807840832e-14 1.025393037312e-14 ] [ -7.257860092224001e-14 1.890568412544e-14 1.714328984256e-14 ] [ -2.899939683648e-14 2.08282960704e-14 -5.928053496960001e-15 ] [ 3.68500622784e-14 -5.014812823104e-14 -1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }