{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5681566 -0.3134907 0.1829932 ] [ 0.072043 0.8043256 -1.5702945 ] [ 0.3181093 -0.7592738 1.2838163 ] [ -1.5429801 0.0331278 0.9245481 ] [ 0.4729007 -0.0405337 -0.6460202 ] [ 1.1188708 0.7918794 -1.1410916 ] [ 0.006082 0.4703107 2.8802279 ] [ -2.0131823 -0.9863453 -1.914179 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.512463862972884e-09 -5.022674745163037e-10 2.931874292208887e-10 ] [ 1.15425611243262e-10 1.28867168244803e-09 -2.515889156398713e-09 ] [ 5.096672875180962e-10 -1.216490741168389e-09 2.056900478208334e-09 ] [ -2.472126662946983e-09 5.307658709582519e-11 1.481289362829095e-09 ] [ 7.576704517422438e-10 -6.494214702956579e-11 -1.035038469532007e-09 ] [ 1.792628652224887e-09 1.268730671625939e-09 -1.828230298773674e-09 ] [ 9.744438287987998e-12 7.535208142601837e-10 4.614633841974888e-09 ] [ -3.225473641042378e-09 -1.58029939271572e-09 -3.066852867093486e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.6388686015624785 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.023580345619659e-19 } }