{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3965492 -3.4214254 -7.1430671 ] [ 1.626373 -4.1936438 7.2137689 ] [ -6.8270752 -3.0841689 0.8312795 ] [ -3.1143659 7.5237617 0.6207307 ] [ 7.9185189 3.1754763 -1.522712 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.353418572369433e-10 -5.481727785691288e-09 -1.144445510842565e-08 ] [ 2.605736797300359e-09 -6.718958052322872e-09 1.155773187943413e-08 ] [ -1.093818027388348e-08 -4.941383306178453e-09 1.331856580250313e-09 ] [ -4.989764233596752e-09 1.205439509621046e-08 9.945202153528186e-10 ] [ 1.268686585294293e-08 5.087673887764487e-09 -2.43965356661161e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 32.823811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.258954258975787e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2544716 0.8986611 -0.9067832 ] [ 3.2867988 0.76979 7.4028319 ] [ -3.2237266 0.7668266 3.9916311 ] [ 0.2676006 7.2327223 3.7831949 ] [ 7.1792899 4.935317 2.7639214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2544716e-10 8.986611e-11 -9.067832e-11 ] [ 3.2867988e-10 7.6979e-11 7.4028319e-10 ] [ -3.2237266e-10 7.668266000000001e-11 3.9916311e-10 ] [ 2.676006e-11 7.2327223e-10 3.7831949e-10 ] [ 7.1792899e-10 4.935317000000001e-10 2.7639214e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }