{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1235609 -0.3260394 0.1015999 ] [ 1.2205107 0.3415554 -3.6746799 ] [ -4.9539468 -1.577559 2.5603837 ] [ 2.8781463 3.9900608 0.5530102 ] [ -1.4514702 -5.3451111 -6.8670505 ] [ -0.5287695 1.7450307 -2.850824 ] [ 1.7119685 1.1720624 10.1775605 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.800143006025007e-09 -5.223727041396596e-10 1.627809844556179e-10 ] [ 1.955473708976243e-09 5.472320765879924e-10 -5.887486224703682e-09 ] [ -7.937097743646974e-09 -2.527528147732627e-09 4.102186904417401e-09 ] [ 4.611298713102023e-09 6.392782129330545e-09 8.860200135039323e-10 ] [ -2.3255116202279e-09 -8.56381203999857e-09 -1.100222776495295e-08 ] [ -8.471821306921056e-10 2.795847390118259e-09 -4.567523562815538e-09 ] [ 2.742875906246045e-09 1.877850975398738e-09 1.630624948987756e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -18.190222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.914394841556182e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2208194 1.954223 3.6267841 ] [ 1.9927538 3.69637 0.8257497 ] [ 1.1145539 3.9250758 2.991082 ] [ 3.0104286 5.1649827 3.6079206 ] [ 3.5653257 2.0195779 1.6063818 ] [ 4.1657621 4.4611235 1.5920337 ] [ 4.3391997 3.136344 3.7220101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2208194e-10 1.954223e-10 3.6267841e-10 ] [ 1.9927538e-10 3.69637e-10 8.257497e-11 ] [ 1.1145539e-10 3.9250758e-10 2.991082e-10 ] [ 3.0104286e-10 5.164982700000001e-10 3.6079206e-10 ] [ 3.5653257e-10 2.0195779e-10 1.6063818e-10 ] [ 4.1657621e-10 4.4611235e-10 1.5920337e-10 ] [ 4.3391997e-10 3.136344e-10 3.7220101e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 2.25e-05 6e-07 ] [ -8.2e-06 1.3e-05 5.36e-05 ] [ -4.15e-05 1.1e-06 1.38e-05 ] [ 4.9e-06 -4.29e-05 -3.48e-05 ] [ 4.07e-05 -3.59e-05 6.6e-06 ] [ 4.74e-05 2.69e-05 1.58e-05 ] [ -3.59e-05 1.54e-05 -5.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.169588933184e-14 3.604897396800001e-14 9.6130597248e-16 ] [ -1.313784829056e-14 2.08282960704e-14 8.587666687488e-14 ] [ -6.64903297632e-14 1.76239428288e-15 2.211003736704e-14 ] [ 7.850665441919999e-15 -6.873337703232e-14 -5.575574640383999e-14 ] [ 6.520858846656e-14 -5.751814068672e-14 1.057436569728e-14 ] [ 7.594317182591999e-14 4.309855109952001e-14 2.531439060864e-14 ] [ -5.751814068672e-14 2.467351996032e-14 -8.892080245440001e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.526286 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.609108878265435e-18 } }