{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] "source-value" [ 5.43808 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] "source-value" [ -0.036104 5.43472 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] "source-value" [ 0.0778792 -0.0548884 5.50823 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 6.818653812987475e-10 1.691894506123248e-09 -2.552895730605078e-09 ] [ -1.137102238714687e-09 -1.25974293098343e-09 -1.814591595009043e-10 ] [ -4.491221503426561e-12 4.241887573344422e-10 1.339388252327032e-09 ] [ 2.183119454795597e-10 1.140688070209699e-09 8.601588000146132e-10 ] [ -8.531314931381223e-10 -8.284884145335973e-10 1.893360525741068e-09 ] [ 7.106959087193953e-10 -1.16145019638566e-09 1.790941064821104e-09 ] [ 6.681345674408295e-10 4.234511152182259e-10 -3.431198059326616e-09 ] [ -2.842826893646342e-10 -4.305410672005901e-10 2.817041463111187e-10 ] ] "source-value" [ [ 0.4255869 1.0559975 -1.5933922 ] [ -0.7097234 -0.7862697 -0.1132579 ] [ -0.0028032 0.2647578 0.8359804 ] [ 0.1362596 0.7119615 0.5368689 ] [ -0.5324828 -0.5171018 1.1817427 ] [ 0.4435815 -0.7249202 1.1178175 ] [ 0.4170168 0.2642974 -2.1415854 ] [ -0.1774353 -0.2687226 0.1758259 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.42028e-12 -1.62787e-12 1.86746e-11 ] [ 1.46625e-10 1.46109e-10 1.35616e-10 ] [ 2.56733e-12 2.72542e-10 2.65757e-10 ] [ 1.37985e-10 4.00669e-10 4.1027e-10 ] [ 2.74744e-10 1.30417e-12 2.60748e-10 ] [ 4.13581e-10 1.33996e-10 3.97093e-10 ] [ 2.70334e-10 2.70384e-10 7.42117e-12 ] [ 4.068030000000001e-10 4.03744e-10 1.33105e-10 ] ] "source-value" [ [ -0.0442028 -0.0162787 0.186746 ] [ 1.46625 1.46109 1.35616 ] [ 0.0256733 2.72542 2.65757 ] [ 1.37985 4.00669 4.1027 ] [ 2.74744 0.0130417 2.60748 ] [ 4.13581 1.33996 3.97093 ] [ 2.70334 2.70384 0.0742117 ] [ 4.06803 4.03744 1.33105 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.029650052636998e-16 "source-value" 642.65702 } }