{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4593317 -5.4700458 -9.9859896 ] [ -5.5849162 -3.9362188 -0.9875193 ] [ 7.1626447 -0.0109746 6.3651139 ] [ -7.1838177 6.6800094 0.7718839 ] [ 4.5513472 0.7405519 -2.443335 ] [ -0.3908269 -3.8530691 4.3788891 ] [ 4.9049005 5.849747 1.900957 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.542460418995497e-09 -8.763979567669836e-09 -1.5999319204487e-08 ] [ -8.948022238488071e-09 -6.306517787671518e-09 -1.582180348084036e-09 ] [ 1.147582197598394e-08 -1.75832476874964e-11 1.019803676332861e-08 ] [ -1.150974486185562e-08 1.070255497558036e-08 1.236694348740792e-09 ] [ 7.292062137061325e-09 1.186494950444305e-09 -3.914654246034389e-09 ] [ -6.261737271186546e-10 -6.173297281207408e-09 7.01575379889729e-09 ] [ 7.858516973194917e-09 9.372327958211596e-09 3.045668887638737e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.997886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.922273260659572e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4812805 2.7594843 0.8796032 ] [ 1.3065793 2.0319249 2.8837723 ] [ 3.5886179 3.6308341 4.9585058 ] [ 1.4152433 4.2525749 3.875168 ] [ 4.6546584 2.1377478 1.9629369 ] [ 3.4312051 1.4241329 3.9428046 ] [ 3.5962283 4.4314902 2.5025693 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4812805e-10 2.7594843e-10 8.796032e-11 ] [ 1.3065793e-10 2.0319249e-10 2.8837723e-10 ] [ 3.5886179e-10 3.6308341e-10 4.9585058e-10 ] [ 1.4152433e-10 4.2525749e-10 3.875168e-10 ] [ 4.6546584e-10 2.1377478e-10 1.9629369e-10 ] [ 3.4312051e-10 1.4241329e-10 3.9428046e-10 ] [ 3.5962283e-10 4.4314902e-10 2.5025693e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 4e-07 -1.5e-06 ] [ 2e-06 -5e-07 -3.3e-06 ] [ 2.1e-06 3.1e-06 -0.0 ] [ 1.4e-06 -1.7e-06 1.5e-06 ] [ -2e-06 -1.4e-06 1.4e-06 ] [ -1.6e-06 -9e-07 1.1e-06 ] [ -1.6e-06 1.1e-06 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706536e-16 6.408706536e-16 -2.403264951e-15 ] [ 3.204353268e-15 -8.010883169999999e-16 -5.2871828922e-15 ] [ 3.364570931399999e-15 4.9667475654e-15 0.0 ] [ 2.2430472876e-15 -2.7237002778e-15 2.403264951e-15 ] [ -3.204353268e-15 -2.2430472876e-15 2.2430472876e-15 ] [ -2.5634826144e-15 -1.4419589706e-15 1.7623942974e-15 ] [ -2.5634826144e-15 1.7623942974e-15 1.4419589706e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.72791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.840324317165494e-18 } }