{ "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" [ [ -4.5759177 -1.8967342 -9.6539251 ] [ -4.7665652 -2.7709994 0.8014675 ] [ 3.3014702 -0.5100066 5.9066927 ] [ -5.1951635 4.8607859 0.289022 ] [ 5.0995913 -0.6076711 -2.2387619 ] [ 1.881365 -6.643223 5.3548803 ] [ 4.25522 7.5678483 -0.4593756 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.331428357644909e-09 -3.038903191111791e-09 -1.54672930941743e-08 ] [ -7.636879324958875e-09 -4.439630454930828e-09 1.284092490831024e-09 ] [ 5.2895383687079e-09 -8.171206509736973e-10 9.463564950190029e-09 ] [ -8.3235695009335e-09 7.787837527694286e-09 4.630642912968576e-10 ] [ 8.17044595649508e-09 -9.73596429555819e-10 -3.586891975717788e-09 ] [ 3.014279018191392e-09 -1.064361657736084e-08 8.57946402384249e-09 ] [ 6.817614000360575e-09 1.212502961602102e-08 -7.360008464859725e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -14.853348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.379768690620644e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2820073 3.0819644 1.1540071 ] [ 1.3090529 1.7248094 3.0148739 ] [ 3.453275 3.5942261 4.852088 ] [ 1.4665585 4.1814702 3.4522779 ] [ 4.4855967 2.2024321 1.9426184 ] [ 3.5015928 1.3245371 3.9842034 ] [ 3.9757298 4.5587497 2.6052913 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2820073e-10 3.0819644e-10 1.1540071e-10 ] [ 1.3090529e-10 1.7248094e-10 3.0148739e-10 ] [ 3.453275e-10 3.5942261e-10 4.852088000000001e-10 ] [ 1.4665585e-10 4.1814702e-10 3.4522779e-10 ] [ 4.4855967e-10 2.2024321e-10 1.9426184e-10 ] [ 3.5015928e-10 1.3245371e-10 3.9842034e-10 ] [ 3.9757298e-10 4.5587497e-10 2.6052913e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.17e-05 2.46e-05 -6.9e-06 ] [ 3.51e-05 -3.4e-06 -2.45e-05 ] [ 7.7e-06 -9.5e-06 3.42e-05 ] [ -6.3e-06 -8.6e-06 -2.24e-05 ] [ 9.4e-06 -4.09e-05 5e-06 ] [ -3.3e-06 -4e-06 2.7e-05 ] [ 1.91e-05 4.19e-05 -1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.885429750336e-14 3.941354487168e-14 -1.105501868352e-14 ] [ 5.623639939008e-14 -5.44740051072e-15 -3.92533272096e-14 ] [ 1.233675998016e-14 -1.52206778976e-14 5.479444043136e-14 ] [ -1.009371271104e-14 -1.377871893888e-14 -3.588875630592e-14 ] [ 1.506046023552e-14 -6.552902379072e-14 8.010883104e-15 ] [ -5.28718284864e-15 -6.4087064832e-15 4.32587687616e-14 ] [ 3.060157345728e-14 6.713120041152e-14 -1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }