{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.2451126 -7.5921105 -16.0030098 ] [ 13.2992028 -11.9326474 3.409623 ] [ -6.7578384 -7.8537215 15.9068094 ] [ -9.0126028 15.0691222 2.5970806 ] [ 11.7163511 12.3093572 -5.9105032 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.48123032643835e-08 -1.21639019456302e-08 -2.563964816399328e-08 ] [ 2.13076718014379e-08 -1.91182086885299e-08 5.462818256341958e-09 ] [ -1.082725069162448e-08 -1.258304897357431e-08 2.548551813220168e-08 ] [ -1.443978149871662e-08 2.414339528481826e-08 4.160981819653236e-09 ] [ 1.877166381350437e-08 1.972176432291615e-08 -9.469670044203588e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 56.087544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.986215171489133e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0874411 1.3857249 -0.4296259 ] [ 4.6214747 -0.043165 2.5922315 ] [ -0.0530284 1.1259344 5.2440663 ] [ -0.7829417 5.982846 2.76866 ] [ 4.230666 5.1012007 0.6862471 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.74411e-12 1.3857249e-10 -4.296259e-11 ] [ 4.621474700000001e-10 -4.3165e-12 2.5922315e-10 ] [ -5.302840000000001e-12 1.1259344e-10 5.2440663e-10 ] [ -7.829417e-11 5.982846e-10 2.76866e-10 ] [ 4.230666e-10 5.1012007e-10 6.862471e-11 ] ] } "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" -2.6645353e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.269056162956315e-34 } }