{ "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" [ 5.5417 0 0 ] "si-unit" "m" "si-value" [ 5.5417e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0877832 5.55439 0 ] "si-unit" "m" "si-value" [ -8.77832e-12 5.55439e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0308884 0.040745 5.63916 ] "si-unit" "m" "si-value" [ 3.08884e-12 4.074500000000001e-12 5.63916e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.159411 -0.0874723 -0.00774134 ] [ 1.28203 1.40365 1.4018 ] [ -0.0744566 2.77196 2.86869 ] [ 1.41795 4.01233 4.00515 ] [ 2.72183 0.105785 2.67146 ] [ 4.038 1.47487 4.29534 ] [ 2.69485 2.74872 0.0100738 ] [ 4.0446 4.15007 1.27967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.59411e-11 -8.747230000000001e-12 -7.74134e-13 ] [ 1.28203e-10 1.40365e-10 1.4018e-10 ] [ -7.44566e-12 2.77196e-10 2.86869e-10 ] [ 1.41795e-10 4.01233e-10 4.00515e-10 ] [ 2.72183e-10 1.05785e-11 2.67146e-10 ] [ 4.038e-10 1.47487e-10 4.29534e-10 ] [ 2.69485e-10 2.74872e-10 1.00738e-12 ] [ 4.0446e-10 4.150070000000001e-10 1.27967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.9336705 -0.5900449 -3.4568552 ] [ -0.6542122 -0.0837933 -0.6619023 ] [ -1.044102 -0.51096 -1.564846 ] [ -2.056516 3.8333403 3.9476765 ] [ 0.6837787 -1.0689775 0.971744 ] [ 0.696227 -1.2882117 -1.0319481 ] [ -0.9938436 0.254522 -0.362389 ] [ -0.5650024 -0.5458748 2.15852 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.302434960955096e-09 -9.453561517908664e-10 -5.538492628561396e-09 ] [ -1.048163500517735e-09 -1.342516673457522e-10 -1.060484399050858e-09 ] [ -1.672835827912668e-09 -8.186481729086399e-10 -2.507159697008364e-09 ] [ -3.294901882647143e-09 6.14168825883055e-09 6.3248750468909e-09 ] [ 1.095534255966896e-09 -1.712690772771735e-09 1.556905531029696e-09 ] [ 1.115478631359918e-09 -2.063942685385417e-09 -1.653363133320695e-09 ] [ -1.592312993770442e-09 4.07789201238948e-10 -5.80611188218626e-10 ] [ -9.052336434339216e-10 -8.745878496494231e-10 3.45833030802168e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.660765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.7134844433565e-18 } }