{ "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" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.7892885 1.3429537 -2.4520869 ] [ -0.3169391 0.4924337 6.5549823 ] [ 15.5132649 17.5455529 -19.722938 ] [ -32.5129738 27.4018463 -16.9629131 ] [ 1.0460249 0.0387361 -0.9972469 ] [ -14.5847102 -14.8256191 11.7770369 ] [ 28.4916041 -24.4412013 15.1915039 ] [ -5.4255592 -7.5547024 6.6116618 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.24798159273663e-08 2.151649020956857e-09 -3.928676303349948e-09 ] [ -5.077924162373932e-10 7.88965761434041e-10 1.050223939081781e-08 ] [ 2.485499033505725e-08 2.811107465538964e-08 -3.159963015708791e-08 ] [ -5.209152649504293e-08 4.390259750861498e-08 -2.717758278948205e-08 ] [ 1.675916639554658e-09 6.206207380097088e-11 -1.597765668345276e-09 ] [ -2.336728170358329e-08 -2.375326031090594e-08 1.886889318347891e-08 ] [ 4.564858197810943e-08 -3.915912130712657e-08 2.433947238337202e-08 ] [ -8.69270410500635e-09 -1.210396756238165e-08 1.059304996059645e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.957986 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.877186532585371e-18 } }