{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0620576 -1.700163 1.7855761 ] [ -1.3852592 -0.1082417 0.2776972 ] [ 7.925104 -17.5151083 15.3215376 ] [ -2.932083 17.5513537 -15.2691349 ] [ 1.4542957 1.7721593 -2.115676 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.110310339862958e-09 -2.723961410149191e-09 2.860808282079243e-09 ] [ -2.219429903988111e-09 -1.734223211356474e-10 4.449199615016217e-10 ] [ 1.269741634620856e-08 -2.806229702904003e-08 2.454780933742814e-08 ] [ -4.697714832845126e-09 2.812036856153158e-08 -2.446385095662135e-08 ] [ 2.330038570269971e-09 2.839312198793294e-09 -3.389686624387661e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.6335728 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.062815525253479e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3340414 0.4844698 2.6229256 ] [ 0.3246159 2.5980306 0.7430717 ] [ 2.7645392 -0.1317372 3.052237 ] [ 2.1573878 1.4700587 1.6635078 ] [ 2.6058883 2.9077986 0.052851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.340414e-11 4.844698e-11 2.6229256e-10 ] [ 3.246159e-11 2.5980306e-10 7.430717000000001e-11 ] [ 2.764539200000001e-10 -1.317372e-11 3.052237e-10 ] [ 2.1573878e-10 1.4700587e-10 1.6635078e-10 ] [ 2.6058883e-10 2.9077986e-10 5.285100000000001e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.3252009 -0.5701721 0.5018295 ] [ -0.4404936 0.1414453 -0.1522369 ] [ -0.1718386 -1.7064431 1.4732936 ] [ 0.6527963 0.4317993 0.099802 ] [ 0.2847368 1.7033708 -1.9226882 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.210292790431187e-10 -9.135164084524397e-10 8.040194925277537e-10 ] [ -7.057485475320268e-10 2.266203527820422e-10 -2.439104020030675e-10 ] [ -2.753157874710029e-10 -2.734023239545476e-09 2.360476561494267e-09 ] [ 1.045894970004743e-09 6.918187433378054e-10 1.599004311090816e-10 ] [ 4.561986440414055e-10 2.729100872313393e-09 -3.080486083128035e-09 ] ] } "relaxed-potential-energy" { "source-value" -11.781817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.8876551747944e-18 } }