{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3785926 -3.1805795 0.5430314 ] [ 2.4864111 -9.3769512 0.274975 ] [ -1.1401926 -1.2789986 0.4166064 ] [ 1.025155 1.9188116 -2.3027434 ] [ 3.4731355 2.4392005 1.2624832 ] [ -3.299051 2.6838002 -7.2414503 ] [ 0.8331347 6.7947171 7.0470977 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.413102074927886e-09 -5.095850115495753e-09 8.700322134402932e-10 ] [ 3.983669734117611e-09 -1.502353198702251e-08 4.405585163044801e-10 ] [ -1.826789926929166e-09 -2.049181654955931e-09 6.674770341556532e-10 ] [ 1.642479373696224e-09 3.074275085239841e-09 -3.689401639181503e-09 ] [ 5.564576498970519e-09 3.90803001454367e-09 2.022721067192771e-09 ] [ -5.28566238302686e-09 4.299921935338364e-09 -1.160208237134515e-08 ] [ 1.334828938317222e-09 1.088633688256997e-08 1.129069517943345e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.798972 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.851709681267382e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0561483 2.8035537 2.8838785 ] [ 4.897344 1.3526198 1.7107373 ] [ 5.600349 1.726676 4.0557881 ] [ 3.3766639 0.983212 3.56302 ] [ 5.439699 3.6358818 2.5988188 ] [ 3.5396527 3.2242088 1.0124798 ] [ 3.362079 4.8121502 2.9046455 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0561483e-10 2.8035537e-10 2.8838785e-10 ] [ 4.897344000000001e-10 1.3526198e-10 1.7107373e-10 ] [ 5.600349e-10 1.726676e-10 4.0557881e-10 ] [ 3.3766639e-10 9.83212e-11 3.56302e-10 ] [ 5.439699e-10 3.6358818e-10 2.5988188e-10 ] [ 3.5396527e-10 3.2242088e-10 1.0124798e-10 ] [ 3.362079e-10 4.8121502e-10 2.9046455e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.36e-05 7.7e-06 2.4e-06 ] [ -1.25e-05 7.2e-06 2.35e-05 ] [ 2.14e-05 -1.67e-05 -1.12e-05 ] [ 3.5e-06 -1e-06 -1.43e-05 ] [ -3.8e-06 1.23e-05 1.24e-05 ] [ 5.5e-06 -1.35e-05 -2.6e-06 ] [ -5e-07 3.9e-06 -1.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.178960204288e-14 1.233675998016e-14 3.84522388992e-15 ] [ -2.002720776e-14 1.153567166976e-14 3.76511505888e-14 ] [ 3.428657968511999e-14 -2.675634956736e-14 -1.794437815296e-14 ] [ 5.6076181728e-15 -1.6021766208e-15 -2.291112567744e-14 ] [ -6.08827115904e-15 1.970677243584e-14 1.986699009792e-14 ] [ 8.8119714144e-15 -2.16293843808e-14 -4.16565921408e-15 ] [ -8.010883104e-16 6.24848882112e-15 -1.618198387008e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.813838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.494962125351863e-18 } }