{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7000694 0.661287 1.948722 ] [ 0.7009801 2.943734 0.5112142 ] [ 1.776961 0.8237646 0.2230389 ] [ 2.520436 2.54344 2.202058 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.000694e-11 6.61287e-11 1.948722e-10 ] [ 7.009801e-11 2.943734e-10 5.112142e-11 ] [ 1.776961e-10 8.237646e-11 2.230389e-11 ] [ 2.520436e-10 2.54344e-10 2.202058e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4542505 -2.8565479 4.3354363 ] [ -0.8605483 3.2074162 -1.4161431 ] [ 1.9998502 -1.9792157 -4.6195696 ] [ 1.3149486 1.6283474 1.7002764 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.932142772686711e-09 -4.576694261575336e-09 6.946134680827655e-09 ] [ -1.378750367329185e-09 5.138847248815177e-09 -2.268911366527236e-09 ] [ 3.204113235542204e-09 -3.171053122060307e-09 -7.401366411278408e-09 ] [ 2.106779904473691e-09 2.608900134820466e-09 2.724143096977989e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.9887974 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.390757939387827e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3949765 0.4417397 2.189327 ] [ 1.4542147 3.0443775 0.2531945 ] [ 1.104359 0.7985826 -0.058145 ] [ 1.7448962 2.6875257 2.5006566 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3949765e-10 4.417397000000001e-11 2.189327e-10 ] [ 1.4542147e-10 3.0443775e-10 2.531945e-11 ] [ 1.104359e-10 7.985826e-11 -5.8145e-12 ] [ 1.7448962e-10 2.6875257e-10 2.5006566e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.02e-05 -1.97e-05 7.8e-06 ] [ 2.09e-05 1.24e-05 -1.6e-05 ] [ -2.21e-05 -1.1e-06 -2.3e-06 ] [ -1.89e-05 8.4e-06 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.236396774016e-14 -3.156287942976e-14 1.249697764224e-14 ] [ 3.348549137472e-14 1.986699009792e-14 -2.56348259328e-14 ] [ -3.540810331968e-14 -1.76239428288e-15 -3.68500622784e-15 ] [ -3.028113813312e-14 1.345828361472e-14 1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.5960346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.056801242610788e-18 } }