{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.638378 0.8784031 3.89936 ] [ 3.076863 3.046669 3.275657 ] [ 5.153788 2.352253 2.384418 ] [ 4.273122 0.1786437 2.239865 ] [ 4.529593 1.652308 4.599133 ] [ 5.775659 4.557099 1.971672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.638378e-10 8.784031e-11 3.89936e-10 ] [ 3.076863e-10 3.046669e-10 3.275657e-10 ] [ 5.153788e-10 2.352253e-10 2.384418e-10 ] [ 4.273122e-10 1.786437e-11 2.239865e-10 ] [ 4.529593e-10 1.652308e-10 4.599133e-10 ] [ 5.775659e-10 4.557099e-10 1.971672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2747668 -4.1529883 0.2145205 ] [ -2.8040242 5.2453747 -1.3641319 ] [ 3.4583309 1.7329026 -2.6776925 ] [ -0.0095434 -2.6951386 -1.69677 ] [ 4.8679501 -0.0570334 5.4832167 ] [ -0.2379466 -0.073117 0.0408572 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.451108047132029e-09 -6.653820760715937e-09 3.436997297823264e-10 ] [ -4.492542017397424e-09 8.404016711675814e-09 -2.185580237867484e-09 ] [ 5.540856914970223e-09 2.776416031843534e-09 -4.290136321191504e-09 ] [ -1.529021236294272e-11 -4.318088054735643e-09 -2.718525224874816e-09 ] [ 7.799315841441021e-09 -9.137758008473473e-11 8.785081603520127e-09 ] [ -3.812324795188493e-10 -1.171463479830336e-10 6.546045063134976e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -12.296384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.970097896517919e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4260692 1.1893659 3.4376548 ] [ 2.8370658 3.5651081 3.5076918 ] [ 5.9919972 1.83957 1.9909104 ] [ 4.3759353 0.1229128 2.5002802 ] [ 4.7755001 1.9814464 4.3202538 ] [ 5.0408353 3.9669726 2.6133141 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4260692e-10 1.1893659e-10 3.4376548e-10 ] [ 2.8370658e-10 3.5651081e-10 3.5076918e-10 ] [ 5.991997200000001e-10 1.83957e-10 1.9909104e-10 ] [ 4.3759353e-10 1.229128e-11 2.5002802e-10 ] [ 4.7755001e-10 1.9814464e-10 4.3202538e-10 ] [ 5.040835300000001e-10 3.9669726e-10 2.6133141e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.4e-06 -5.78e-05 5.1e-06 ] [ 3.06e-05 3.96e-05 -4.62e-05 ] [ -8.9e-06 -5.1e-05 -3.04e-05 ] [ -3.5e-06 3.77e-05 1.38e-05 ] [ 5.9e-06 -1.12e-05 1e-05 ] [ -2.95e-05 4.26e-05 4.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.65175375232e-15 -9.260580868224001e-14 8.17110076608e-15 ] [ 4.902660459647999e-14 6.344619418368e-14 -7.402055988096e-14 ] [ -1.425937192512e-14 -8.17110076608e-14 -4.870616927232e-14 ] [ -5.6076181728e-15 6.040205860416e-14 2.211003736704e-14 ] [ 9.45284206272e-15 -1.794437815296e-14 1.6021766208e-14 ] [ -4.72642103136e-14 6.825272404608e-14 7.642382481215999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.712533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.517425302614849e-18 } }