{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7945484 -1.2219263 -7.0513572 ] [ -6.0418269 -1.2822624 -0.6548271 ] [ -4.1049627 6.1173501 1.7037364 ] [ 1.2215792 -1.9029062 -1.1862289 ] [ 4.2094914 -5.838683 3.8673034 ] [ 5.2579682 3.0534239 1.0286874 ] [ 1.2522992 1.0750038 2.292686 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.875183491374047e-09 -1.957741750200647e-09 -1.129751965074975e-08 ] [ -9.68007380610054e-09 -2.054410839010898e-09 -1.049148670286264e-09 ] [ -6.576875267196044e-09 9.801075311468542e-09 2.729686628085957e-09 ] [ 1.957185634695568e-09 -3.048791825215369e-09 -1.900548210497301e-09 ] [ 6.744348706538661e-09 -9.354601398862407e-09 6.19610309302035e-09 ] [ 8.424193722949858e-09 4.892124385971957e-09 1.648138902391538e-09 ] [ 2.006404500486543e-09 1.722345955631159e-09 3.673287908035469e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.834164 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.056259750831301e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3219723 2.7264742 1.1583906 ] [ 1.2408138 1.660062 3.1667172 ] [ 1.7724998 4.1210726 3.1826245 ] [ 4.2856899 1.3205637 1.6203586 ] [ 3.5344391 1.3005968 4.0369694 ] [ 5.0415372 3.2352223 3.1132048 ] [ 3.3716729 3.6403984 4.9875578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3219723e-10 2.7264742e-10 1.1583906e-10 ] [ 1.2408138e-10 1.660062e-10 3.1667172e-10 ] [ 1.7724998e-10 4.1210726e-10 3.182624500000001e-10 ] [ 4.2856899e-10 1.3205637e-10 1.6203586e-10 ] [ 3.5344391e-10 1.3005968e-10 4.0369694e-10 ] [ 5.0415372e-10 3.2352223e-10 3.1132048e-10 ] [ 3.3716729e-10 3.6403984e-10 4.987557800000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 0.0 1e-07 ] [ -2.04e-05 -3.5e-06 -1.8e-06 ] [ -2.2e-06 -4.9e-06 3e-07 ] [ 1.1e-06 1.02e-05 1.5e-06 ] [ 1.03e-05 -5e-07 2e-07 ] [ 8.3e-06 -8e-06 8.8e-06 ] [ 4.8e-06 6.7e-06 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 0.0 1.6021766208e-16 ] [ -3.268440306432e-14 -5.6076181728e-15 -2.88391791744e-15 ] [ -3.52478856576e-15 -7.850665441919999e-15 4.8065298624e-16 ] [ 1.76239428288e-15 1.634220153216e-14 2.4032649312e-15 ] [ 1.650241919424e-14 -8.010883104e-16 3.2043532416e-16 ] [ 1.329806595264e-14 -1.28174129664e-14 1.409915426304e-14 ] [ 7.69044777984e-15 1.073458335936e-14 -1.474002491136e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.641115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.826418201784419e-18 } }