{ "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" [ [ -1.585305700982976e-10 5.148131221462065e-09 8.739828605518618e-10 ] [ 1.271899510180815e-08 -1.334189749954354e-08 -1.415755328043284e-08 ] [ -9.391616965985737e-09 1.55529444950163e-08 1.880825720708811e-08 ] [ 1.309067860866703e-09 -1.147311740730112e-08 9.023232821442068e-10 ] [ -1.904634561968652e-09 2.84206409735718e-09 5.742336873524644e-09 ] [ -5.140585290013421e-10 -1.490997419423474e-09 2.634352793271481e-09 ] [ -1.869104693225791e-09 5.353670935355932e-09 -7.443571909129494e-09 ] [ -1.901174821773696e-10 -2.590798262705682e-09 -7.360127666800312e-09 ] ] "source-value" [ [ -0.09894700000000002 3.213210800000001 0.5454972000000001 ] [ 7.938572400000002 -8.327357500000002 -8.836449800000002 ] [ -5.861786300000001 9.707384500000002 11.739190900000002 ] [ 0.8170559000000002 -7.160956700000002 0.5631859000000001 ] [ -1.1887794000000003 1.7738769000000005 3.5840848000000007 ] [ -0.3208501000000001 -0.9306074000000002 1.6442337000000005 ] [ -1.1666034000000003 3.341498600000001 -4.645912200000001 ] [ -0.11866200000000003 -1.6170491000000005 -4.593830400000001 ] ] } "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" -4.917234979714432e-18 "source-value" -30.690967 } }