{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4139087 0.2453898 -1.8757203 ] [ 0.0187449 -0.7364618 1.5357166 ] [ -0.1073923 -1.9329651 -0.284799 ] [ 0.43587 0.6490411 2.6579842 ] [ -0.3754926 1.2199389 -0.8082283 ] [ -0.5946153 0.8088164 0.4864345 ] [ 0.558948 0.1324565 -1.905816 ] [ -1.3499714 -0.3862158 0.1944283 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.265331481749315e-09 3.931578037819331e-10 -3.00523523657947e-09 ] [ 3.00326407866666e-11 -1.179941887793581e-09 2.460489252965924e-09 ] [ -1.720614337315182e-10 -3.096951517557473e-09 -4.56298303186566e-10 ] [ 6.983407294615799e-10 1.039878484925657e-09 4.258560178781183e-09 ] [ -6.016054699599084e-10 1.954557600487663e-09 -1.294924497197542e-09 ] [ -9.526787398789002e-10 1.295866737275997e-09 7.793539898714729e-10 ] [ 8.955334252210319e-10 2.12218709321421e-10 -3.053453863903344e-09 ] [ -2.162892633648267e-09 -6.187859304416172e-10 3.115084792483422e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.278594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.812471562117259e-18 } }