{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3773584 -5.4489323 -1.5450425 ] [ 2.0455058 -1.5420965 0.5174631 ] [ -2.042482 2.4615519 3.7069255 ] [ -0.0737725 -0.2527591 0.0347547 ] [ 4.448107 4.782236 -2.7141008 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.013301289342495e-09 -8.730151939381973e-09 -2.475430971642384e-09 ] [ 3.277261570470801e-09 -2.470710959317507e-09 8.290672809466924e-10 ] [ -3.272416908804826e-09 3.94384090506582e-09 5.93914937114735e-09 ] [ -1.18196574757968e-10 -4.049647207144493e-10 5.568316780291776e-11 ] [ 7.126653042216826e-09 7.66198671434811e-09 -4.348468848254577e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.658314 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.226997164554533e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3251421 0.1898171 1.291407 ] [ 0.8527243 2.514385 0.6337677 ] [ -0.2764428 2.6617311 2.8540912 ] [ 2.8730936 0.0674897 1.7768382 ] [ 2.8153127 2.4048865 0.9109344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.251421e-11 1.898171e-11 1.291407e-10 ] [ 8.527243e-11 2.514385e-10 6.337677e-11 ] [ -2.764428e-11 2.6617311e-10 2.8540912e-10 ] [ 2.8730936e-10 6.74897e-12 1.7768382e-10 ] [ 2.8153127e-10 2.4048865e-10 9.109344e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-05 -6.01e-05 1.15e-05 ] [ 8.82e-05 2.5e-05 -9.21e-05 ] [ 6.35e-05 -9.9e-06 2.44e-05 ] [ -8.1e-06 -3e-07 8.5e-06 ] [ -0.0001046 4.54e-05 4.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.248488821120001e-14 -9.629081491008e-14 1.84250311392e-14 ] [ 1.4131197795456e-13 4.005441552e-14 -1.4756046677568e-13 ] [ 1.017382154208e-13 -1.586154854592e-14 3.909310954752e-14 ] [ -1.297763062848e-14 -4.8065298624e-16 1.36185012768e-14 ] [ -1.6758767453568e-13 7.273881858432e-14 7.626360715008e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.351186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.818660482755227e-18 } }