{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8908333999999998 1.9606048999999997 -1.2131631999999999 ] [ 0.5124199999999999 -0.9462340999999997 -0.9273777999999998 ] [ -0.7649070999999997 1.7830081999999996 0.28180239999999995 ] [ 0.021854299999999997 -1.1051471999999998 0.3881864999999999 ] [ -0.6233703999999999 0.23746519999999993 -0.17878229999999998 ] [ 1.1811111999999997 -1.0211584999999999 0.3964391999999999 ] [ -2.0883604999999994 -0.007302099999999998 -0.9020874999999998 ] [ 0.8704191999999997 -0.9012364999999998 2.1549826999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.427272446507774e-09 3.141235333405921e-09 -1.943701716254914e-09 ] [ 8.209873440303358e-10 -1.516034152823729e-09 -1.485823029808938e-09 ] [ -1.225516272703927e-09 2.85669405273469e-09 4.514972169653298e-10 ] [ 3.501444852394944e-11 -1.770641006382582e-09 6.21943334810179e-10 ] [ -9.987494809787441e-10 3.80461191693596e-10 -2.864408212728519e-10 ] [ 1.892348751205033e-09 -1.636076274831197e-09 6.351656178086552e-10 ] [ -3.345922368902198e-09 -1.169925390274368e-11 -1.44530350241592e-09 ] [ 1.394565292535439e-09 -1.443940050111619e-09 3.45266290016846e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.337236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.821866998369211e-18 } }