{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.284773 1.136187 2.117179 ] [ 0.232979 2.36751 0.607179 ] [ 0.4870779 2.766051 2.845032 ] [ 1.778488 1.070505 1.035652 ] [ 2.177899 0.7799475 2.527686 ] [ 2.528264 2.860392 0.629956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84773e-11 1.136187e-10 2.117179e-10 ] [ 2.32979e-11 2.36751e-10 6.07179e-11 ] [ 4.870779e-11 2.766051e-10 2.845032e-10 ] [ 1.778488e-10 1.070505e-10 1.035652e-10 ] [ 2.177899e-10 7.799475000000001e-11 2.527686e-10 ] [ 2.528264e-10 2.860392e-10 6.29956e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.1292686 -24.6790357 12.4004605 ] [ -9.8401501 14.2336389 -16.0607491 ] [ 0.9820358 20.2660694 12.1623478 ] [ 9.2181468 -7.3317563 -50.0376895 ] [ 22.7824719 -12.1525132 44.7609721 ] [ 5.9867641 9.6635969 -3.2253417 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.667023351642989e-08 -3.954017434819184e-08 1.986772806393996e-08 ] [ -1.576565856527276e-08 2.280480366237346e-08 -2.573215693255653e-08 ] [ 1.573394812511497e-09 3.24698228557024e-08 1.94862294597413e-08 ] [ 1.476909941174187e-08 -1.174676863004229e-08 -8.016921693624714e-08 ] [ 3.650154414294158e-08 -1.947047269341656e-08 7.171498361374591e-08 ] [ 9.591853554290038e-09 1.548278915357483e-08 -5.167567108405838e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 19.535544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.12993921292789e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0419734 1.4997772 2.733933 ] [ 0.0249937 2.0921307 0.4296443 ] [ -1.0384844 2.6851059 4.4279796 ] [ 2.3014969 1.4061949 0.3195277 ] [ 2.2345383 0.8138433 2.6238224 ] [ 4.0089099 2.4835405 -0.772223 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.19734e-12 1.4997772e-10 2.733933e-10 ] [ 2.49937e-12 2.0921307e-10 4.296443e-11 ] [ -1.0384844e-10 2.6851059e-10 4.4279796e-10 ] [ 2.3014969e-10 1.4061949e-10 3.195277000000001e-11 ] [ 2.2345383e-10 8.138433000000001e-11 2.6238224e-10 ] [ 4.0089099e-10 2.4835405e-10 -7.72223e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.29e-05 -4e-05 1.29e-05 ] [ -2.63e-05 1.3e-05 5.3e-06 ] [ -2.2e-05 2.6e-05 1.62e-05 ] [ 2.08e-05 -2.28e-05 -2.66e-05 ] [ -9.1e-06 2.91e-05 -4.03e-05 ] [ 3.7e-06 -5.3e-06 3.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.271161125859999e-14 -6.408706535999999e-14 2.06680785786e-14 ] [ -4.21372454742e-14 2.082829624199999e-14 8.4915361602e-15 ] [ -3.5247885948e-14 4.165659248399999e-14 2.59552614708e-14 ] [ 3.332527398719999e-14 -3.65296272552e-14 -4.26178984644e-14 ] [ -1.45798073694e-14 4.66233400494e-14 -6.456771835019998e-14 ] [ 5.9280535458e-15 -8.4915361602e-15 5.19105229416e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.969384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.238142063617345e-18 } }