{ "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" [ [ -1.8936342 -7.1668811 0.1964717 ] [ -1.0489218 6.4519993 -1.5794012 ] [ 4.747691 -3.4590868 -1.1564565 ] [ -4.9241665 -5.1774522 -1.5291302 ] [ 0.5815713 -4.8382684 -0.8248483 ] [ 0.6650178 10.8778985 -0.0462688 ] [ 1.8724425 3.3117906 4.9396333 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.033936468583283e-09 -1.148260943707622e-08 3.147823669822578e-10 ] [ -1.680557998853221e-09 1.033724252104435e-08 -2.53047969835156e-09 ] [ 7.606639585652093e-09 -5.54206804593783e-09 -1.852847582537421e-09 ] [ -7.88938450822556e-09 -8.295192938491895e-09 -2.449936676783746e-09 ] [ 9.317799478650043e-10 -7.751760579500564e-09 -1.321552672854622e-09 ] [ 1.065475980354085e-09 1.742831480372365e-08 -7.413079024321918e-11 ] [ 2.999983622008544e-09 5.30607351602084e-09 7.914165053788311e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.9815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.5605185876271e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6516553 2.3982741 3.5163045 ] [ 2.7194968 4.6718598 2.6500482 ] [ 5.9182054 2.7357933 1.2386856 ] [ 3.4785046 2.7650173 1.1242047 ] [ 4.9238415 1.6010479 3.1477781 ] [ 5.0223442 4.9024725 1.8898228 ] [ 4.5363253 3.9349451 4.2776281 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6516553e-10 2.3982741e-10 3.5163045e-10 ] [ 2.7194968e-10 4.6718598e-10 2.6500482e-10 ] [ 5.9182054e-10 2.7357933e-10 1.2386856e-10 ] [ 3.4785046e-10 2.7650173e-10 1.1242047e-10 ] [ 4.9238415e-10 1.6010479e-10 3.1477781e-10 ] [ 5.0223442e-10 4.9024725e-10 1.8898228e-10 ] [ 4.5363253e-10 3.9349451e-10 4.2776281e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.62e-05 5.6e-06 -1.06e-05 ] [ 1.74e-05 -2.07e-05 -2.04e-05 ] [ -5.5e-06 -1.76e-05 -3.2e-06 ] [ -1.58e-05 -7.46e-05 -4.1e-06 ] [ -1.69e-05 -2.83e-05 -2.18e-05 ] [ 1.3e-06 9.97e-05 5.29e-05 ] [ 4.58e-05 3.59e-05 7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.197702781079999e-14 8.972189150399999e-15 -1.69830723204e-14 ] [ 2.78778734316e-14 -3.316505632379999e-14 -3.26844033336e-14 ] [ -8.811971486999999e-15 -2.81983087584e-14 -5.1269652288e-15 ] [ -2.53143908172e-14 -1.195223768964e-13 -6.568924199399999e-15 ] [ -2.70767851146e-14 -4.53415987422e-14 -3.492745062119999e-14 ] [ 2.0828296242e-15 1.597370104098e-13 8.475514393859999e-14 ] [ 7.33796898372e-14 5.751814116059999e-14 1.16958894282e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.095233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.540046603538572e-18 } }