{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.133712 1.3759547 2.1639187 ] [ -0.465707 0.8421423 1.1381982 ] [ 2.6411654 0.5605511 -1.7564227 ] [ 1.0699858 -1.5812222 -0.9385117 ] [ -4.3791561 -1.1974259 -0.6071825 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.816406876085408e-09 2.20452246978248e-09 3.466979979015655e-09 ] [ -7.461448736902378e-10 1.349260715563018e-09 1.823594560900859e-09 ] [ 4.231613490409264e-09 8.981018745829973e-10 -2.814099409367192e-09 ] [ 1.714306247471797e-09 -2.533397262002074e-09 -1.503661516475617e-09 ] [ -7.016181580058568e-09 -1.918487797926421e-09 -9.72813614073705e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.660517 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.829526768175977e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7455355 1.7472596 0.5098973 ] [ 1.8165385 1.8273905 2.6051175 ] [ 3.0665448 1.3764203 0.6470412 ] [ 2.1842961 3.541145 1.0152266 ] [ 3.9660513 2.7493777 2.3350253 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.455355000000001e-11 1.7472596e-10 5.098973e-11 ] [ 1.8165385e-10 1.8273905e-10 2.6051175e-10 ] [ 3.0665448e-10 1.3764203e-10 6.470412000000001e-11 ] [ 2.1842961e-10 3.541145e-10 1.0152266e-10 ] [ 3.9660513e-10 2.7493777e-10 2.3350253e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 -5e-07 1.2e-06 ] [ -3.5e-06 -1.2e-06 3.9e-06 ] [ 2.2e-06 3e-07 -4.5e-06 ] [ 3e-06 -1e-07 -1.3e-06 ] [ -1e-07 1.6e-06 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.5634826144e-15 -8.010883169999999e-16 1.9226119608e-15 ] [ -5.607618218999999e-15 -1.9226119608e-15 6.248488872599999e-15 ] [ 3.5247885948e-15 4.806529901999999e-16 -7.209794853e-15 ] [ 4.806529901999999e-15 -1.602176634e-16 -2.0828296242e-15 ] [ -1.602176634e-16 2.5634826144e-15 1.2817413072e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245508681305e-18 } }