{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.5665167 -20.3442039 -9.8973736 ] [ 1.7055358 9.7515421 -8.7286663 ] [ 24.6370268 -13.6423269 1.0779206 ] [ -11.3502866 24.6051889 -6.6827767 ] [ 1.5742406 -0.3702001 24.2308959 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.654248574483277e-08 -3.259500785736818e-08 -1.585734058924313e-08 ] [ 2.732569584697425e-09 1.562369276936694e-08 -1.398486507662484e-08 ] [ 3.947286834498304e-08 -2.185741721249094e-08 1.727019184398708e-09 ] [ -1.818516382989952e-08 3.942185840594767e-08 -1.070698859076698e-08 ] [ 2.522211484834164e-09 -5.93125945237822e-10 3.882217491201857e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.3178675 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.172451622261214e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9699986 2.1723535 1.7339349 ] [ 4.777716 1.1309618 3.195909 ] [ 5.3229815 3.1521214 1.744255 ] [ 3.2996394 4.696963 1.6481063 ] [ 3.8230565 3.4174293 3.7878678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9699986e-10 2.1723535e-10 1.7339349e-10 ] [ 4.777716e-10 1.1309618e-10 3.195909e-10 ] [ 5.3229815e-10 3.1521214e-10 1.744255e-10 ] [ 3.2996394e-10 4.696963e-10 1.6481063e-10 ] [ 3.8230565e-10 3.4174293e-10 3.7878678e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 -7.32e-05 7e-06 ] [ -7e-06 -5.73e-05 3.93e-05 ] [ 0.000162 -2.24e-05 -0.0001475 ] [ -4.63e-05 0.0001034 5.33e-05 ] [ -0.0001037 4.95e-05 4.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 -1.1727932864256e-13 1.12152363456e-14 ] [ -1.12152363456e-14 -9.180472037184001e-14 6.296554119743999e-14 ] [ 2.595526125696e-13 -3.588875630592e-14 -2.36321051568e-13 ] [ -7.418077754303999e-14 1.6566506259072e-13 8.539601388864e-14 ] [ -1.6614571557696e-13 7.930774272959999e-14 7.674426013632e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842912488295e-18 } }