{ "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" [ [ 1.2172312 0.2776752 -1.5691138 ] [ 0.0640439 -0.5345032 1.3569927 ] [ -0.0809317 -1.2312471 -0.08831 ] [ 0.4215701 0.599865 2.5187125 ] [ -0.4818307 0.9583862 -0.6412093 ] [ -0.4202332 0.539433 0.2336079 ] [ 0.3980764 -0.2762627 -1.738728 ] [ -1.1179258 -0.3333464 -0.0719521 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.950219370748329e-09 4.448847136159642e-10 -2.513997445734647e-09 ] [ 1.026096392848531e-10 -8.563685307827864e-10 2.174141978536268e-09 ] [ -1.296668776215994e-10 -1.9726753180478e-09 -1.41488217382848e-10 ] [ 6.754297582483181e-10 9.61089678636192e-10 4.03542228201672e-09 ] [ -7.719778827236987e-10 1.535503963337353e-09 -1.027330549499533e-09 ] [ -6.732878083239705e-10 8.642669410880064e-10 3.742811158141843e-10 ] [ 6.377887013722291e-10 -4.426216391390842e-10 -2.785749351530343e-09 ] [ -1.791114580549137e-09 -5.340798087078451e-10 -1.152799724374637e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.32159524065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.775225492953677e-18 } }