{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2477696 -5.8523812 2.7691838 ] [ -0.6362899 -1.6209058 -3.1926897 ] [ -5.973552 8.5187993 3.4560449 ] [ -3.3225501 2.0148475 0.9973812 ] [ 0.9112549 -2.4267731 -1.8664879 ] [ 4.851364 -2.6722859 -10.8677816 ] [ 4.4175428 2.0386993 8.7043493 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.969706604649677e-10 -9.37654833464945e-09 4.436721543058103e-09 ] [ -1.01944880183117e-09 -2.596977377279121e-09 -5.115252794808965e-09 ] [ -9.57068535753308e-09 1.36486210757474e-08 5.537194339215074e-09 ] [ -5.323312091656702e-09 3.228141558977328e-09 1.597980840665449e-09 ] [ 1.459991296369442e-09 -3.888119124806341e-09 -2.990443276386088e-09 ] [ 7.772741979790772e-09 -4.281473993073487e-09 -1.741210559948042e-08 ] [ 7.07768379554337e-09 3.266356355301326e-09 1.394590494773685e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -13.258381 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.124226806785893e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1324299 1.8815186 4.4836043 ] [ 2.1145279 3.1462828 1.257084 ] [ 2.6084424 5.113826 2.9591373 ] [ 1.1841214 3.1225265 3.6144561 ] [ 3.7742127 1.4467 2.1404289 ] [ 4.614469 3.8158951 1.8174959 ] [ 4.41189 3.987041 4.3380335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1324299e-10 1.8815186e-10 4.4836043e-10 ] [ 2.1145279e-10 3.1462828e-10 1.257084e-10 ] [ 2.6084424e-10 5.113826e-10 2.9591373e-10 ] [ 1.1841214e-10 3.122526500000001e-10 3.6144561e-10 ] [ 3.7742127e-10 1.4467e-10 2.1404289e-10 ] [ 4.614469e-10 3.8158951e-10 1.8174959e-10 ] [ 4.41189e-10 3.987041e-10 4.3380335e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.87e-05 1.11e-05 2.61e-05 ] [ -9.1e-06 1.04e-05 -3.5e-05 ] [ -1.6e-06 4.2e-06 -1.31e-05 ] [ 1.4e-06 -3.34e-05 -9.2e-06 ] [ -4.37e-05 -1.29e-05 9e-07 ] [ 9.9e-06 2.14e-05 1.79e-05 ] [ 2.45e-05 -9e-07 1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.996070280896e-14 1.778416049088e-14 4.181680980288e-14 ] [ -1.457980724928e-14 1.666263685632e-14 -5.6076181728e-14 ] [ -2.56348259328e-15 6.72914180736e-15 -2.098851373248e-14 ] [ 2.24304726912e-15 -5.351269913472e-14 -1.474002491136e-14 ] [ -7.001511832895999e-14 -2.066807840832e-14 1.44195895872e-15 ] [ 1.586154854592e-14 3.428657968511999e-14 2.867896151232001e-14 ] [ 3.92533272096e-14 -1.44195895872e-15 1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }