{ "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" [ [ 0.8904438 -0.2684407 -1.0495133 ] [ 0.4087938 -0.5973394 0.0629866 ] [ -0.0889096 -1.6751186 0.3290714 ] [ 0.1327627 0.3779838 1.0836333 ] [ -0.3332799 1.0476764 0.1267027 ] [ -0.6156009 0.7500562 0.4166437 ] [ 0.0825769 0.4486628 -0.8630977 ] [ -0.4767869 -0.0834806 -0.1064268 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.426648238496311e-09 -4.300894136111865e-10 -1.681505672478657e-09 ] [ 6.549598690879911e-10 -9.570432213626995e-10 1.009156579436813e-10 ] [ -1.424488824846797e-10 -2.683835857987227e-09 5.272305036539252e-10 ] [ 2.127092940542842e-10 6.055968074011431e-10 1.736171938780353e-09 ] [ -5.339732639625619e-10 1.678562634243909e-09 2.030001037322362e-10 ] [ -9.863013697234387e-10 1.201722507926089e-09 6.67536795343609e-10 ] [ 1.323027785981395e-10 7.188370487826662e-10 -1.382834956406252e-09 ] [ -7.638968242837075e-10 -1.337506656103565e-10 -1.705145307865574e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 647.56694 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.037516611670996e-16 } }