{ "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" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.9626815 -7.5853935 0.4740369 ] [ -5.2101569 8.3680326 0.1786284 ] [ 6.617515 -3.3990731 -0.7274263 ] [ -6.4334063 -5.9890382 -6.615175 ] [ 3.1178923 -4.6804249 0.6595206 ] [ 2.6674504 10.3642085 -1.9446627 ] [ 7.2033871 2.9216886 7.9750782 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.275762213817668e-08 -1.215314012526828e-08 7.594908385765075e-10 ] [ -8.347591575879804e-09 1.340706619381224e-08 2.861942462909107e-10 ] [ 1.060242782079331e-08 -5.445915453210181e-09 -1.165465411215047e-09 ] [ -1.030745316596743e-08 -9.595496985118115e-09 -1.059867872750064e-08 ] [ 4.995414149232339e-09 -7.498867350190179e-09 1.056668486255989e-09 ] [ 4.273726668023608e-09 1.660529255179664e-08 -3.115693113281804e-09 ] [ 1.154109840219231e-08 4.681061168177883e-09 1.277748384109175e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7246823 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.558065862576757e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6095068 2.2699488 2.8023262 ] [ 2.7313615 4.5893638 3.3925252 ] [ 5.7823346 2.4098635 1.4719994 ] [ 3.4427178 2.8013943 0.6191602 ] [ 4.860366 1.892979 3.622741 ] [ 4.7532371 4.8483998 1.6901582 ] [ 5.0708492 4.1974608 4.2455618 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6095068e-10 2.2699488e-10 2.8023262e-10 ] [ 2.7313615e-10 4.5893638e-10 3.392525200000001e-10 ] [ 5.782334600000001e-10 2.4098635e-10 1.4719994e-10 ] [ 3.4427178e-10 2.8013943e-10 6.191602000000001e-11 ] [ 4.860366000000001e-10 1.892979e-10 3.622741e-10 ] [ 4.7532371e-10 4.848399800000001e-10 1.6901582e-10 ] [ 5.0708492e-10 4.1974608e-10 4.2455618e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -5.8e-06 -3.57e-05 ] [ -5.27e-05 1.53e-05 1.3e-06 ] [ 6.32e-05 -5.41e-05 1.92e-05 ] [ -4.66e-05 3.92e-05 2.16e-05 ] [ 1.17e-05 -4.82e-05 -1.75e-05 ] [ -1.41e-05 -8.1e-06 1.38e-05 ] [ 3.52e-05 6.18e-05 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 -9.292624400640001e-15 -5.719770536256001e-14 ] [ -8.443470791616e-14 2.451330229824e-14 2.08282960704e-15 ] [ 1.0125756243456e-13 -8.667775518528e-14 3.076179111936e-14 ] [ -7.466143052928e-14 6.280532353535999e-14 3.460701500928e-14 ] [ 1.874546646336e-14 -7.722491312256001e-14 -2.8038090864e-14 ] [ -2.259069035328e-14 -1.297763062848e-14 2.211003736704e-14 ] [ 5.639661705216e-14 9.901451516544e-14 -4.32587687616e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.765666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846373471814145e-18 } }