{ "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" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7986563 -6.688875 0.334956 ] [ -6.9464203 2.249504 2.219084 ] [ -5.9673732 5.2574296 2.0568561 ] [ -1.7070914 -7.3509403 -10.8716383 ] [ 3.700735 -0.1760793 8.3395084 ] [ 4.8617593 6.7527285 -4.6893344 ] [ 6.8570468 -0.0437675 2.6105683 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.279588451914631e-09 -1.07167591444536e-08 5.366586721966848e-10 ] [ -1.112939220291052e-08 3.604102717196083e-09 3.555364504391347e-09 ] [ -9.560785828628483e-09 8.423330790621896e-09 3.295446755769867e-09 ] [ -2.735061930648741e-09 -1.177750468955654e-08 -1.741828471405386e-08 ] [ 5.929231096776287e-09 -2.821101378668294e-10 1.336136538744522e-08 ] [ 7.789397086416973e-09 1.081906372930985e-08 -7.513141942793194e-09 ] [ 1.098620007069145e-08 -7.0123265250864e-11 4.182591497261601e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6004267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.37794025876441e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.8252346 0.9292074 3.2930368 ] [ 1.315865 3.3450172 3.8789055 ] [ 2.2077212 5.4237243 3.0875163 ] [ 2.3425414 2.2555297 1.9443349 ] [ 3.1230165 2.5308521 5.2263298 ] [ 3.8631629 4.1708523 1.8906207 ] [ 5.0969434 3.1707917 3.685578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.8252346e-10 9.292074e-11 3.2930368e-10 ] [ 1.315865e-10 3.3450172e-10 3.8789055e-10 ] [ 2.2077212e-10 5.4237243e-10 3.0875163e-10 ] [ 2.3425414e-10 2.2555297e-10 1.9443349e-10 ] [ 3.1230165e-10 2.5308521e-10 5.2263298e-10 ] [ 3.8631629e-10 4.1708523e-10 1.8906207e-10 ] [ 5.0969434e-10 3.1707917e-10 3.685578e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.3e-06 -5.9e-06 -6.8e-06 ] [ -1.08e-05 -7.8e-06 2.22e-05 ] [ 1.4e-05 -7e-07 3.7e-06 ] [ -1.3e-06 7.7e-06 -9.9e-06 ] [ 8.9e-06 2.16e-05 -3.56e-05 ] [ -9.2e-06 -1.82e-05 -5.9e-06 ] [ -9.8e-06 3.3e-06 3.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.329806595264e-14 -9.45284206272e-15 -1.089480102144e-14 ] [ -1.730350750464e-14 -1.249697764224e-14 3.556832098176e-14 ] [ 2.24304726912e-14 -1.12152363456e-15 5.928053496960001e-15 ] [ -2.08282960704e-15 1.233675998016e-14 -1.586154854592e-14 ] [ 1.425937192512e-14 3.460701500928e-14 -5.703748770048e-14 ] [ -1.474002491136e-14 -2.915961449856e-14 -9.45284206272e-15 ] [ -1.570133088384e-14 5.28718284864e-15 5.159008718975999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }