{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1163934 1.179779 -0.7400112 ] [ 1.5827434 0.2079524 5.013045 ] [ -0.5737608 0.4583773 -0.2145469 ] [ 1.9161155 -3.1128333 -4.1482429 ] [ -6.455977 2.0275005 1.4560555 ] [ 10.7181073 -5.3157877 -4.8050303 ] [ -4.8749974 8.7724177 6.3906482 ] [ 3.8041624 -4.2174059 -2.9519175 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.799542589831814e-09 1.890214347083886e-09 -1.185628653538301e-09 ] [ 2.535834493097716e-09 3.331764762642216e-10 8.031783564190528e-09 ] [ -9.192661472651471e-10 7.344013996160081e-10 -3.437420300771346e-10 ] [ 3.069955482145227e-09 -4.987308778797112e-09 -6.646217846536397e-09 ] [ -1.034361549904142e-08 3.248413926523317e-09 2.332858099907187e-09 ] [ 1.717230107676483e-08 -8.5168308442446e-09 -7.69850727232201e-09 ] [ -7.81060692509075e-09 1.405496266262802e-08 1.023894722215416e-08 ] [ 6.094940109221362e-09 -6.75702918907374e-09 -4.729493243995694e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.80022 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.415392270805948e-18 } }