{ "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" [ [ 3.8155201 0.4052826 -4.5440492 ] [ -0.7359922 -2.0372302 5.0278219 ] [ -0.9238891 -4.5944141 -1.7561573 ] [ 0.9871278 1.9293049 7.4566426 ] [ -0.325652 2.7614845 -2.9470797 ] [ -1.0865842 1.9642364 0.522435 ] [ 2.0402388 0.9938447 -4.6374101 ] [ -3.7707692 -1.4225088 0.8777968 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.113137150777343e-09 6.493343118867683e-10 -7.280369451986392e-09 ] [ -1.179189505646255e-09 -3.264002624519147e-09 8.055458768093484e-09 ] [ -1.480233528427289e-09 -7.361062917940139e-09 -2.813674191688528e-09 ] [ 1.581553095931825e-09 3.091087230641706e-09 1.194685854180901e-08 ] [ -5.21752025215368e-10 4.424385941053173e-09 -4.721742233875729e-09 ] [ -1.740899816113583e-09 3.147053663732277e-09 8.370331497837899e-10 ] [ 3.268822933140199e-09 1.59231475616474e-09 -7.429950104495603e-09 ] [ -6.041438304446872e-09 -2.279110361019379e-09 1.406385522359971e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.10993 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.625230946737562e-18 } }