{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4646052 0.3428206 -0.3311673 ] [ -1.8656501 -0.3406378 0.9609399 ] [ -2.8043756 0.5341775 -1.4661707 ] [ 0.8191606 0.9121256 -1.2176293 ] [ 0.0706514 -0.0982767 -2.7383054 ] [ 3.3643746 -1.7353829 3.8671171 ] [ 0.8804443 0.3851737 0.9252156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.443795954748966e-10 5.492591549738602e-10 -5.305885100048682e-10 ] [ -2.989100997439763e-09 -5.457619238171651e-10 1.539595454458296e-09 ] [ -4.49310505927973e-09 8.558467089085349e-10 -2.349064436995423e-09 ] [ 1.31243997281342e-09 1.46138632359323e-09 -1.950857213333776e-09 ] [ 1.131960222393876e-10 -1.574566324066278e-10 -4.387248928636023e-09 ] [ 5.390322372143096e-09 -2.780389933423158e-09 6.195804658561842e-09 ] [ 1.410627284998486e-09 6.171163021713257e-10 1.48235881573229e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.132761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.667582895810647e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0099597 1.43609 2.9202501 ] [ 1.9476873 2.3684789 5.0459991 ] [ 2.3487171 3.5685258 1.9297555 ] [ 3.0065011 4.2154389 4.1188067 ] [ 3.9330936 1.7890068 1.6615833 ] [ 4.1070465 2.0147903 4.070766 ] [ 4.6570477 3.8081114 2.5322964 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0099597e-10 1.43609e-10 2.9202501e-10 ] [ 1.9476873e-10 2.3684789e-10 5.0459991e-10 ] [ 2.3487171e-10 3.5685258e-10 1.9297555e-10 ] [ 3.0065011e-10 4.2154389e-10 4.118806700000001e-10 ] [ 3.9330936e-10 1.7890068e-10 1.6615833e-10 ] [ 4.1070465e-10 2.0147903e-10 4.070766e-10 ] [ 4.6570477e-10 3.8081114e-10 2.5322964e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 -2e-07 -7.8e-06 ] [ -7.2e-06 -3.7e-06 7.4e-06 ] [ -2.13e-05 8.8e-06 -6.5e-06 ] [ -2e-07 1.3e-06 -9.3e-06 ] [ 2.4e-06 4.3e-06 1.29e-05 ] [ 1.85e-05 -9e-06 5.4e-06 ] [ 1.31e-05 -1.5e-06 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.4915361602e-15 -3.204353268e-16 -1.24969777452e-14 ] [ -1.15356717648e-14 -5.9280535458e-15 1.18561070916e-14 ] [ -3.41263623042e-14 1.40991543792e-14 -1.0414148121e-14 ] [ -3.204353268e-16 2.0828296242e-15 -1.49002426962e-14 ] [ 3.845223921599999e-15 6.8893595262e-15 2.06680785786e-14 ] [ 2.9640267729e-14 -1.4419589706e-14 8.6517538236e-15 ] [ 2.09885139054e-14 -2.403264951e-15 -3.364570931399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.380528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.867497209018275e-18 } }