{ "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" [ 5.4 0 0 ] "si-unit" "m" "si-value" [ 5.400000000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.386566 5.8038 0 ] "si-unit" "m" "si-value" [ 3.86566e-11 5.8038e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.433064 -0.220286 5.20849 ] "si-unit" "m" "si-value" [ -4.33064e-11 -2.20286e-11 5.20849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0990081 -0.244555 -0.290689 ] [ 1.37678 1.31208 1.41317 ] [ 0.146167 2.66383 2.23753 ] [ 1.10278 3.83154 3.71513 ] [ 2.55958 0.422069 2.77183 ] [ 3.95966 1.45431 4.3569 ] [ 2.78855 2.68274 0.381413 ] [ 4.33575 3.68618 1.46711 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.90081e-12 -2.44555e-11 -2.90689e-11 ] [ 1.37678e-10 1.31208e-10 1.41317e-10 ] [ 1.46167e-11 2.66383e-10 2.23753e-10 ] [ 1.10278e-10 3.83154e-10 3.71513e-10 ] [ 2.55958e-10 4.22069e-11 2.77183e-10 ] [ 3.95966e-10 1.45431e-10 4.356900000000001e-10 ] [ 2.78855e-10 2.68274e-10 3.81413e-11 ] [ 4.33575e-10 3.68618e-10 1.46711e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2558058000000001 -2.4363216000000003 1.1724344000000002 ] [ -0.8015227000000003 -6.427407000000001 -3.729901400000001 ] [ 0.6438032000000001 -2.3776401000000003 3.5914946000000008 ] [ 4.386869400000001 3.9610483000000007 1.6453963000000005 ] [ 1.7344437000000004 -6.723279100000002 2.2575753000000005 ] [ 1.3885708000000003 0.5838225000000001 -1.4956126000000003 ] [ -2.3619773000000004 2.9483727000000006 -2.2880480000000003 ] [ -4.734381300000001 10.471404200000002 -1.1533387000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.098460722250408e-10 -3.90341750827005e-09 1.878446985101676e-09 ] [ -1.284180930980493e-09 -1.029784122776627e-08 -5.975960820969191e-09 ] [ 1.031486435436227e-09 -3.809399380896574e-09 5.754208681849449e-09 ] [ 7.028539591182925e-09 6.346298980119586e-09 2.636215483810824e-09 ] [ 2.778885146233849e-09 -1.077188058913327e-08 3.617034365355547e-09 ] [ 2.224735672085553e-09 9.353867601970082e-10 -2.396235541493903e-09 ] [ -3.784304808920309e-09 4.723813809344974e-09 -3.665857012868199e-09 ] [ -7.585315032812712e-09 1.677703899618693e-08 -1.847852301003865e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 156.4924 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.507284646128819e-17 } }