{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.8647449 -9.2851147 -5.5087095 ] [ 1.030113 0.699751 -1.8340424 ] [ 14.2271504 -24.3923723 11.6265695 ] [ 9.0247641 17.2540212 -24.9047448 ] [ -11.4172826 15.7237147 20.6209272 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.061159351133603e-08 -1.48763936937864e-08 -8.825925571678858e-09 ] [ 1.65042296538215e-09 1.121124692581421e-09 -2.938459854835922e-09 ] [ 2.279440775148537e-08 -3.908088862490953e-08 1.862781783300635e-08 ] [ 1.445926604925515e-08 2.764398938142756e-08 -3.990179986555037e-08 ] [ -1.829250325478664e-08 2.519216808446928e-08 3.303836745905881e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.6206573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.220963896118885e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5314252 0.6054053 0.090473 ] [ 0.7640362 0.3777913 2.5661047 ] [ 3.1813905 0.2745356 1.9493376 ] [ 2.5163488 2.0935847 0.3734441 ] [ 1.2077652 2.8270948 2.3694928 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.314252e-11 6.054053e-11 9.047300000000001e-12 ] [ 7.640362000000001e-11 3.777913e-11 2.5661047e-10 ] [ 3.1813905e-10 2.745356e-11 1.9493376e-10 ] [ 2.5163488e-10 2.0935847e-10 3.734441e-11 ] [ 1.2077652e-10 2.8270948e-10 2.3694928e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 2.62e-05 2.08e-05 ] [ 2.03e-05 7.6e-06 -2.98e-05 ] [ -1.46e-05 2.41e-05 1.22e-05 ] [ -2.08e-05 -2.76e-05 1.19e-05 ] [ 9.4e-06 -3.02e-05 -1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 4.197702746496e-14 3.332527371264e-14 ] [ 3.252418540224e-14 1.217654231808e-14 -4.774486329984001e-14 ] [ -2.339177866368e-14 3.861245656128e-14 1.954655477376e-14 ] [ -3.332527371264e-14 -4.422007473408001e-14 1.906590178752e-14 ] [ 1.506046023552e-14 -4.838573394816e-14 -2.419286697408e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }