{ "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" [ 5.43808 0 0 ] "si-unit" "m" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.036104 5.43472 0 ] "si-unit" "m" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0778792 -0.0548884 5.50823 ] "si-unit" "m" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "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 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.987438062521546e-09 6.642234675206611e-09 -1.019490130365587e-08 ] [ -8.088424994297004e-09 -7.224350147066898e-09 4.520742285780903e-09 ] [ 6.219173846727701e-10 9.591138823293612e-10 -5.185941350697539e-11 ] [ 6.966116604381671e-10 2.001076158185199e-09 2.142513267299114e-09 ] [ -1.485491711922414e-10 -2.291309333910655e-09 2.681800635120622e-09 ] [ -3.634939840564133e-10 -1.415007635915842e-09 5.978727508815478e-09 ] [ 4.932101617213393e-09 4.644195763266485e-09 -1.126488757145233e-08 ] [ -3.637600735517881e-09 -3.31595336209426e-09 6.187864271163736e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.070072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.618844991109765e-18 } }