{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.894831 -2.9790504 7.0402751 ] [ 4.5410988 7.2791546 -6.6632302 ] [ 4.1201123 0.3195899 4.0562845 ] [ 3.1525559 -7.6667052 -6.8298886 ] [ -4.013181 5.5376786 3.8992003 ] [ -6.2521342 1.1639002 -4.5462357 ] [ -5.4432829 -3.6545677 3.0435946 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.240207170167084e-09 -4.772964903064889e-09 1.127976416922038e-08 ] [ 7.275642330102936e-09 1.166249131930878e-08 -1.067567164544851e-08 ] [ 6.601147602130515e-09 5.120394660238098e-10 6.498884193213418e-09 ] [ 5.050951358745103e-09 -1.228341583000579e-08 -1.094268783758844e-08 ] [ -6.429824773238766e-09 8.872339186424474e-09 6.247207560476346e-09 ] [ -1.001702324534411e-08 1.864773689384445e-09 -7.283872551186323e-09 ] [ -8.721100602780423e-09 -5.855262928070829e-09 4.876376111313128e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.080973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.300156153391604e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2407991 2.3885713 2.7805672 ] [ 2.3207555 1.5127811 4.5153291 ] [ 2.5989217 3.8427019 1.7887406 ] [ 2.6056692 3.6345409 3.9845159 ] [ 3.4043504 1.9795827 2.6518045 ] [ 4.3463283 2.425644 4.595644 ] [ 4.5182438 3.8656141 2.9105196 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2407991e-10 2.3885713e-10 2.7805672e-10 ] [ 2.3207555e-10 1.5127811e-10 4.5153291e-10 ] [ 2.5989217e-10 3.8427019e-10 1.7887406e-10 ] [ 2.6056692e-10 3.6345409e-10 3.9845159e-10 ] [ 3.4043504e-10 1.9795827e-10 2.6518045e-10 ] [ 4.3463283e-10 2.425644e-10 4.595644e-10 ] [ 4.5182438e-10 3.8656141e-10 2.9105196e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.57e-05 -1.99e-05 -1.3e-05 ] [ 6.8e-06 -2.05e-05 7.3e-06 ] [ -9.1e-06 -2.01e-05 -2.5e-06 ] [ -2.71e-05 9.22e-05 3.48e-05 ] [ 7.2e-06 -4.2e-06 -4.75e-05 ] [ 1.35e-05 -1.89e-05 1.61e-05 ] [ 2.44e-05 -8.6e-06 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.515417294656e-14 -3.188331475392e-14 -2.08282960704e-14 ] [ 1.089480102144e-14 -3.28446207264e-14 1.169588933184e-14 ] [ -1.457980724928e-14 -3.220375007808e-14 -4.005441552e-15 ] [ -4.341898642368e-14 1.4772068443776e-13 5.575574640383999e-14 ] [ 1.153567166976e-14 -6.72914180736e-15 -7.610338948800001e-14 ] [ 2.16293843808e-14 -3.028113813312e-14 2.579504359488e-14 ] [ 3.909310954752e-14 -1.377871893888e-14 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -52.328123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.383889528094676e-18 } }