{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1891247 0.1254057 0.5097027 ] [ 0.1704606 0.070667 -0.2562088 ] [ -0.3232531 -0.4426827 0.088422 ] [ -0.29713 0.6110999 -0.2184173 ] [ 0.2607978 -0.36449 -0.1234986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.030111727558138e-10 2.009220806550586e-10 8.166337494986361e-10 ] [ 2.731079880875404e-10 1.132210152620736e-10 -4.104917494032231e-10 ] [ -5.179085594211246e-10 -7.092558723726201e-10 1.416676611643776e-10 ] [ -4.76054739338304e-10 9.79089972753218e-10 -3.499430916382599e-10 ] [ 4.178441379160743e-10 -5.83977356515392e-10 -1.978665696215309e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.55831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.012063067875885e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1116142 2.5902221 1.6684347 ] [ 1.961218 1.7992389 3.922225 ] [ 1.7062994 4.8285402 2.4124075 ] [ 0.1646384 3.0763738 2.9725794 ] [ 3.5028777 3.551408 3.3620584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1116142e-10 2.5902221e-10 1.6684347e-10 ] [ 1.961218e-10 1.7992389e-10 3.922225e-10 ] [ 1.7062994e-10 4.828540200000001e-10 2.4124075e-10 ] [ 1.646384e-11 3.0763738e-10 2.9725794e-10 ] [ 3.5028777e-10 3.551408e-10 3.3620584e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-06 -1.2e-06 -2e-06 ] [ -8e-07 -4e-07 3.5e-06 ] [ -1e-06 3.8e-06 1.8e-06 ] [ -2.2e-06 -1.3e-06 -1.4e-06 ] [ 2.5e-06 -9e-07 -1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-15 -1.92261194496e-15 -3.2043532416e-15 ] [ -1.28174129664e-15 -6.408706483200001e-16 5.6076181728e-15 ] [ -1.6021766208e-15 6.08827115904e-15 2.88391791744e-15 ] [ -3.52478856576e-15 -2.08282960704e-15 -2.24304726912e-15 ] [ 4.005441552e-15 -1.44195895872e-15 -3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }