{ "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" [ [ 5.98743801319229e-09 6.642234620482622e-09 -1.01949012196622e-08 ] [ -8.088424927658154e-09 -7.224350087546982e-09 4.520742248535448e-09 ] [ 6.219173795489223e-10 9.591138744274214e-10 -5.185941307971648e-11 ] [ 6.966116546989286e-10 2.001076141698749e-09 2.142513249647393e-09 ] [ -1.485491699683757e-10 -2.291309315033034e-09 2.681800613025825e-09 ] [ -3.634939810616621e-10 -1.415007624257889e-09 5.978727459557987e-09 ] [ 4.932101576578834e-09 4.644195725003923e-09 -1.126488747864327e-08 ] [ -3.637600705548446e-09 -3.31595333477481e-09 6.187864220183211e-09 ] ] "source-value" [ [ 3.7370649 4.1457568 -6.3631569 ] [ -5.0483978 -4.5090847 2.8216254 ] [ 0.3881703 0.5986318 -0.0323681 ] [ 0.4347908 1.2489735 1.3372516 ] [ -0.0927171 -1.4301228 1.6738483 ] [ -0.2268751 -0.8831783 3.7316282 ] [ 3.0783757 2.898679 -7.0309898 ] [ -2.2704118 -2.0696553 3.8621611 ] ] } "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" -5.618844944817271e-18 "source-value" -35.070072 } }