{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.527411 -4.2381775 3.9906866 ] [ -0.8455854 -0.1876358 0.672004 ] [ 3.4531429 -5.2771161 2.8132366 ] [ 0.4343489 1.0223186 1.780746 ] [ 0.9358472 0.2340764 -1.2099432 ] [ -3.0540788 3.3750296 -5.8934407 ] [ -1.4587441 0.2526016 0.7382652 ] [ -4.9923416 4.8189033 -2.8915545 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.85588867775275e-09 -6.790308905300592e-09 6.393784771459841e-09 ] [ -1.354777158769816e-09 -3.006256919851046e-10 1.076669097884083e-09 ] [ 5.532544822661512e-09 -8.454872040667275e-09 4.507301909298882e-09 ] [ 6.959036528501972e-10 1.637934959928987e-09 2.853069608783117e-09 ] [ 1.499392504481142e-09 3.750317355610291e-10 -1.938542707535939e-09 ] [ -4.89317365144092e-09 5.407393519627976e-09 -9.442332905611188e-09 ] [ -2.337165692749938e-09 4.047123778966733e-10 1.182831243390236e-09 ] [ -7.998612994567265e-09 7.720734205155969e-09 -4.632781017669033e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.179519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.476162625198939e-18 } }