{ "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" [ [ 1.2386921 1.2987449 -3.0110149 ] [ -1.4888423 -1.399699 0.4952938 ] [ 0.1620973 0.1723531 0.4641139 ] [ 0.068431 0.7355328 0.7149888 ] [ -0.4174955 -0.5654797 1.3460202 ] [ 0.1179204 -0.627758 1.8259541 ] [ 0.7285617 0.6194357 -2.721304 ] [ -0.4093646 -0.2331298 0.885948 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.984603522989656e-09 2.080818715163234e-09 -4.82417767766045e-09 ] [ -2.3853883251181e-09 -2.242565013957139e-09 7.935481467871912e-10 ] [ 2.597085043548039e-10 2.761401073424045e-10 7.435924399683092e-10 ] [ 1.096385483379648e-10 1.178453455991562e-09 1.145538339493847e-09 ] [ -6.689015293892063e-10 -9.059983548769978e-10 2.156562095564541e-09 ] [ 1.889293079953843e-10 -1.005779191120166e-09 2.925500969673905e-09 ] [ 1.167284522550303e-09 9.924453966288827e-10 -4.360009646889523e-09 ] [ -6.558743915031438e-10 -3.735151151717798e-10 1.419445172844518e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -41.270559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.612272475714703e-18 } }