{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0454357 1.9910868 -0.5266317 ] [ -1.0096609 0.7670705 -0.2974027 ] [ 1.5071535 1.5933478 -1.4548149 ] [ -0.2922958 0.855571 -2.7654524 ] [ 0.2047232 -1.2278934 1.679929 ] [ -1.4846932 -1.3181985 2.269498 ] [ 2.7815995 -1.189857 1.0626182 ] [ -1.7522621 -1.4711274 0.0322564 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.27960168894338e-11 3.190072747225831e-09 -8.437570044636977e-10 ] [ -1.61765510224341e-09 1.228982431730697e-09 -4.764916568285118e-10 ] [ 2.414726121551319e-09 2.552824614995305e-09 -2.330870439575046e-09 ] [ -4.683095009763372e-10 1.370775864928014e-09 -4.43074321771922e-09 ] [ 3.280027274777088e-10 -1.967302114522815e-09 2.691542990578986e-09 ] [ -2.378740753698688e-09 -2.111986835673849e-09 3.636136666509732e-09 ] [ 4.456613724046082e-09 -1.906361083201338e-09 1.702502050903138e-09 ] [ -2.807433393263771e-09 -2.357005945917172e-09 5.168045037695759e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -34.67351129230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.555308961126378e-18 } }