{ "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" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0396857 -0.2195991 1.0565066 ] [ -9.9693122 -2.3552167 -4.7892454 ] [ -11.2446953 46.8410279 -16.6219864 ] [ 20.4261111 -47.9512013 -13.4585384 ] [ 0.7482106 3.6849892 33.8132636 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.358350124393379e-11 -3.518365468674293e-10 1.692710188186784e-09 ] [ -1.597259906389113e-08 -3.773473164746588e-09 -7.673217074371983e-09 ] [ -1.801598806610962e-08 7.504760041392208e-08 -2.663135822074578e-08 ] [ 3.272623792790803e-08 -7.682629429509042e-08 -2.156295575227174e-08 ] [ 1.19876554063112e-09 5.904003592782353e-09 5.417482085920272e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.7149 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.87693390496466e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3886846 0.7389157 2.9749227 ] [ 0.5506586 1.4529071 0.7107758 ] [ 1.8590581 3.3909201 -0.1514837 ] [ 3.1080535 1.6203442 1.0799174 ] [ 2.7156542 0.8912597 3.3107978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.886846e-11 7.389157e-11 2.9749227e-10 ] [ 5.506586e-11 1.4529071e-10 7.107758e-11 ] [ 1.8590581e-10 3.3909201e-10 -1.514837e-11 ] [ 3.1080535e-10 1.6203442e-10 1.0799174e-10 ] [ 2.7156542e-10 8.912597000000001e-11 3.3107978e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.02e-05 1.02e-05 -3.67e-05 ] [ 2.22e-05 1.32e-05 2.2e-05 ] [ -1.15e-05 -2.31e-05 1.2e-05 ] [ -2.41e-05 -6.7e-06 1.26e-05 ] [ 3.2e-06 6.4e-06 -9.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.63422016668e-14 1.63422016668e-14 -5.879988246779999e-14 ] [ 3.55683212748e-14 2.11487315688e-14 3.5247885948e-14 ] [ -1.8425031291e-14 -3.70102802454e-14 1.9226119608e-14 ] [ -3.86124568794e-14 -1.07345834478e-14 2.01874255884e-14 ] [ 5.1269652288e-15 1.02539304576e-14 -1.58615486766e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.164352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.788726390815117e-18 } }