{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44714e-10 0.0 0.0 ] "source-value" [ 5.44714 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] "source-value" [ 0.103058 5.37075 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] "source-value" [ 0.0454409 0.00880856 5.43207 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.185300437323328e-11 8.364999385082456e-10 -1.59023960388673e-09 ] [ 3.891852196332804e-09 -3.540496145132661e-09 -5.553190791032465e-09 ] [ -3.393138513917174e-09 2.923874760403793e-09 4.840693074485319e-09 ] [ 8.004527269345286e-10 -3.751316953604009e-09 1.570877299424362e-09 ] [ -1.102126242429637e-09 1.604852255756736e-11 2.114488456849346e-09 ] [ -1.001223562116584e-09 1.507932746740654e-09 4.843339389609893e-09 ] [ 3.853500734343053e-10 1.856132189562497e-09 -5.004417100099939e-09 ] [ 3.669801571708608e-10 1.513249409639117e-10 -1.221550404914461e-09 ] ] "source-value" [ [ 0.03236410000000001 0.5221022000000001 -0.9925495000000002 ] [ 2.4291031000000003 -2.2098039000000003 -3.466029100000001 ] [ -2.1178305000000006 1.8249391000000004 3.021323000000001 ] [ 0.4996033000000001 -2.3413879000000004 0.9804645000000002 ] [ -0.6878931000000001 0.010016700000000002 1.3197599000000002 ] [ -0.6249146000000001 0.9411776000000002 3.0229747000000007 ] [ 0.24051660000000005 1.1585066000000002 -3.123511500000001 ] [ 0.22905100000000006 0.09444960000000002 -0.7624318000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.513609078121765e-17 "source-value" 156.88714 } }