{ "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" [ 5.48715 0 0 ] "si-unit" "m" "si-value" [ 5.48715e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0853536 5.45185 0 ] "si-unit" "m" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0925937 0.0373061 5.50955 ] "si-unit" "m" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4711582 -0.5181117 0.6650566 ] [ 1.4825261 -1.4535139 -0.9540775 ] [ -0.2707344 0.1341599 3.4066663 ] [ -2.8331806 -3.3363133 2.9091985 ] [ 2.4445317 4.2217032 -1.0844721 ] [ -1.1797562 0.6011524 -0.4897681 ] [ 0.4257753 -0.4293367 -2.0873558 ] [ 1.4019963 0.7802601 -2.3652478 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.357055292957498e-09 -8.301064595420176e-10 1.065538144807484e-09 ] [ 2.375268676715148e-09 -2.328786007774212e-09 -1.528600677525135e-09 ] [ -4.337643297000095e-10 2.149478569997766e-10 5.458081145695233e-09 ] [ -4.5392557572221e-09 -5.345363212963431e-09 4.661049860367849e-09 ] [ 3.916571570812298e-09 6.763914222723029e-09 -1.737515858844911e-09 ] [ -1.890177817456631e-09 9.631523287530215e-10 -7.846950058985753e-10 ] [ 6.821672369943401e-10 -6.878732288586678e-10 -3.344312689604377e-09 ] [ 2.246245712814454e-09 1.250114500662503e-09 -3.789544758779905e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.947265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.759386803920601e-18 } }