{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2650317 -3.5213542 -11.7503878 ] [ -5.8564044 -7.2658937 8.8098826 ] [ -6.3107419 7.3858493 -0.7012305 ] [ 6.3582084 -4.6459328 -0.7021746 ] [ 8.0739696 8.0473314 4.3439104 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.628980865009298e-09 -5.641831419277763e-09 -1.882619677359866e-08 ] [ -9.382994288934789e-09 -1.164124511126781e-08 1.411498805000317e-08 ] [ -1.011092321538476e-08 1.183343517070526e-08 -1.123495122148137e-09 ] [ 1.018697293258252e-08 -7.443604975294194e-09 -1.125007737108296e-09 ] [ 1.293592543674632e-08 1.28932463351345e-08 6.959711743069594e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.240395 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.800909822593043e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0680039 2.8957495 1.0291989 ] [ 2.5849006 2.3696001 3.5080784 ] [ 1.7553847 4.5578352 2.4685214 ] [ 4.8534194 1.772672 2.4811341 ] [ 4.2603094 4.2304053 2.8872032 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0680039e-10 2.8957495e-10 1.0291989e-10 ] [ 2.5849006e-10 2.3696001e-10 3.5080784e-10 ] [ 1.7553847e-10 4.557835200000001e-10 2.468521400000001e-10 ] [ 4.853419400000001e-10 1.772672e-10 2.4811341e-10 ] [ 4.2603094e-10 4.230405300000001e-10 2.8872032e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.17e-05 6.84e-05 5.43e-05 ] [ -3.91e-05 8.48e-05 -2e-05 ] [ 9.66e-05 -7.68e-05 2.3e-06 ] [ 8.86e-05 -6.76e-05 -8e-06 ] [ -0.0001145 -8.7e-06 -2.86e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.078899929779999e-14 1.095888817656e-13 8.69981912262e-14 ] [ -6.26451063894e-14 1.358645785632e-13 -3.204353268e-14 ] [ 1.547702628444e-13 -1.230471654912e-13 3.685006258199999e-15 ] [ 1.419528497724e-13 -1.083071404584e-13 -1.2817413072e-14 ] [ -1.83449224593e-13 -1.39389367158e-14 -4.58222517324e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582415215248651e-18 } }