{ "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" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.0718253 0.0473088 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.18253e-12 4.73088e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4856254 -5.5692509 -1.2199068 ] [ 1.7529763 -2.0087154 -3.0889932 ] [ 30.8620514 -39.9847769 29.8266568 ] [ -0.2623005 -5.8029213 -49.0890813 ] [ -25.8671018 53.3656646 23.5713245 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.03911174727569e-08 -8.92292366086347e-09 -1.954506170617711e-09 ] [ 2.808577667815774e-09 -3.218316878235963e-09 -4.949112727624888e-09 ] [ 4.944645763038698e-08 -6.406267526488295e-08 4.778757259529721e-08 ] [ -4.202517321865169e-10 -9.297304915800905e-09 -7.864937904338633e-08 ] [ -4.144366609325934e-08 8.550122088000095e-08 3.776542534633173e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.604472 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.500112042430724e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1379127 -0.0181509 1.8786684 ] [ 3.5155117 0.5008214 0.2485682 ] [ 2.2967988 0.7262072 2.5806541 ] [ 1.2580277 1.8249399 0.6023327 ] [ 1.9546633 3.3440642 2.647235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.379127e-11 -1.81509e-12 1.8786684e-10 ] [ 3.5155117e-10 5.008214e-11 2.485682e-11 ] [ 2.2967988e-10 7.262072e-11 2.5806541e-10 ] [ 1.2580277e-10 1.8249399e-10 6.023327000000001e-11 ] [ 1.9546633e-10 3.3440642e-10 2.647235e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.3e-06 3.4e-06 2.1e-06 ] [ -1.25e-05 -3.02e-05 -3.9e-06 ] [ 2.46e-05 -5.3e-06 2e-06 ] [ 7.2e-06 1.67e-05 -2.44e-05 ] [ -2.76e-05 1.53e-05 2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.32980660622e-14 5.4474005556e-15 3.364570931399999e-15 ] [ -2.0027207925e-14 -4.838573434679999e-14 -6.248488872599999e-15 ] [ 3.94135451964e-14 -8.4915361602e-15 3.204353268e-15 ] [ 1.15356717648e-14 2.67563497878e-14 -3.909310986959999e-14 ] [ -4.42200750984e-14 2.45133025002e-14 3.877267454279999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.793383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049725931241282e-18 } }