{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3591077 0.0526383 -1.5956135 ] [ -0.0695866 -2.9290796 -3.578068 ] [ 0.4633237 -0.743697 5.1626538 ] [ -9.4448609 6.5782825 5.2422396 ] [ 9.9449843 -1.732171 -9.9655435 ] [ -2.9750508 7.1050195 -4.638538 ] [ 4.440298 -8.3309928 9.3728696 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.779707202889261e-09 8.433585361865665e-11 -2.556454645532861e-09 ] [ -1.114900236409613e-10 -4.692902855582217e-09 -5.732696897232614e-09 ] [ 7.423264000025529e-10 -1.191533946359098e-09 8.27148321964428e-09 ] [ -1.513233532068805e-08 1.053957042651778e-08 8.398993727751945e-09 ] [ 1.593362133968305e-08 -2.775243879427757e-09 -1.596656080926541e-08 ] [ -4.766556837452337e-09 1.13834961332281e-08 -7.43175713829239e-09 ] [ 7.114141644985e-09 -1.334772189221313e-08 1.501699254292705e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3339765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.335250230659661e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7921476 3.1218964 2.6998535 ] [ 2.5865633 2.2739588 1.3782972 ] [ 2.2166947 1.6910888 4.3767144 ] [ 1.7529291 5.1599146 3.5481631 ] [ 4.339372 3.6942626 2.0800511 ] [ 3.1209512 5.860976 1.5408786 ] [ 3.6265029 3.7962928 4.419384 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.921476e-11 3.1218964e-10 2.6998535e-10 ] [ 2.5865633e-10 2.2739588e-10 1.3782972e-10 ] [ 2.2166947e-10 1.6910888e-10 4.3767144e-10 ] [ 1.7529291e-10 5.1599146e-10 3.5481631e-10 ] [ 4.339372e-10 3.6942626e-10 2.0800511e-10 ] [ 3.1209512e-10 5.860976e-10 1.5408786e-10 ] [ 3.6265029e-10 3.7962928e-10 4.419384e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.35e-05 4.7e-06 2.83e-05 ] [ 3.77e-05 -5.9e-06 -2.1e-06 ] [ 1.39e-05 2.45e-05 -2.52e-05 ] [ -2.3e-06 -2.8e-06 -1.12e-05 ] [ -1.55e-05 -5.91e-05 -2.3e-06 ] [ -6.6e-06 2.75e-05 2.32e-05 ] [ -1.37e-05 1.1e-05 -1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.16293843808e-14 7.53023011776e-15 4.534159836864e-14 ] [ 6.040205860416e-14 -9.45284206272e-15 -3.36457090368e-15 ] [ 2.227025502912e-14 3.92533272096e-14 -4.037485084416e-14 ] [ -3.68500622784e-15 -4.48609453824e-15 -1.794437815296e-14 ] [ -2.48337376224e-14 -9.468863828927999e-14 -3.68500622784e-15 ] [ -1.057436569728e-14 4.4059857072e-14 3.717049760256e-14 ] [ -2.194981970496e-14 1.76239428288e-14 -1.698307218048e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.891963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026826143961863e-18 } }