{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] "source-value" [ 5.51626 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] "source-value" [ 0.0156708 5.55287 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] "source-value" [ 0.0707378 -0.0779479 5.31818 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.484151438603015e-09 1.281832300272062e-09 1.153625005552011e-09 ] [ -3.181985253797011e-10 -2.767997234571879e-10 5.860851800777165e-10 ] [ -1.10624672026301e-09 2.068506148050048e-10 -5.098142029151808e-10 ] [ 1.507591803555748e-09 -1.208129131579682e-09 -1.565869856613713e-09 ] [ 7.817836842959808e-11 8.86500346054848e-10 1.457912472203954e-09 ] [ 9.145994798481005e-10 -9.523368275390996e-10 -3.630432887782311e-10 ] [ -2.091577331171906e-09 -1.938977538270824e-09 -2.183452226879737e-09 ] [ 4.499804363584185e-09 2.001059959714879e-09 1.424556917353181e-09 ] ] "source-value" [ [ -2.1746363 0.8000568 0.7200361 ] [ -0.1986039 -0.1727648 0.3658056 ] [ -0.6904649 0.129106 -0.318201 ] [ 0.9409648 -0.7540549 -0.9773391 ] [ 0.0487951 0.55331 0.9099574 ] [ 0.5708481 -0.5944019 -0.2265938 ] [ -1.3054599 -1.2102146 -1.3628037 ] [ 2.808557 1.2489634 0.8891385 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.892861126156258e-18 "source-value" -61.746383 } }