{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6593944 0.3813803 5.1579927 ] [ 1.4383158 -3.6082211 -13.692534 ] [ -1.5103932 -3.5316776 3.3521743 ] [ -3.0875688 7.0792286 0.827863 ] [ 9.8190406 -0.3207103 4.3545041 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.066952601636644e-08 6.110386002936902e-10 8.26401531419707e-09 ] [ 2.304435948087249e-09 -5.781007489097259e-09 -2.193785785430911e-08 ] [ -2.419916673255298e-09 -5.658371282923055e-09 5.370775292306606e-09 ] [ -4.946830546471512e-09 1.134217455621872e-08 1.32638274382535e-09 ] [ 1.5731837288006e-08 -5.138345447097543e-10 6.976684664197744e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.088941 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.097079526123057e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9642366 2.5119235 0.2259862 ] [ 1.7089496 2.8355408 2.7412691 ] [ 2.7356595 0.6895015 1.8301604 ] [ 2.3967963 4.79623 1.2673938 ] [ 4.0254751 2.881134 1.6791106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9642366e-10 2.5119235e-10 2.259862e-11 ] [ 1.7089496e-10 2.8355408e-10 2.7412691e-10 ] [ 2.7356595e-10 6.895015e-11 1.8301604e-10 ] [ 2.3967963e-10 4.796230000000001e-10 1.2673938e-10 ] [ 4.0254751e-10 2.881134e-10 1.6791106e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.93e-05 2.69e-05 -4.88e-05 ] [ 3.04e-05 3.55e-05 -4e-05 ] [ -2.33e-05 -8.72e-05 6.57e-05 ] [ -3.1e-05 -5.1e-06 5.83e-05 ] [ 4.6e-06 2.99e-05 -3.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.092200878144e-14 4.309855109952001e-14 -7.818621909504e-14 ] [ 4.870616927232e-14 5.68772700384e-14 -6.4087064832e-14 ] [ -3.733071526464e-14 -1.3970980133376e-13 1.0526300398656e-13 ] [ -4.96674752448e-14 -8.17110076608e-15 9.340689699264e-14 ] [ 7.370012455680001e-15 4.790508096192e-14 -5.639661705216e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842912488295e-18 } }