{ "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" [ 5.51626 0 0 ] "si-unit" "m" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0156708 5.55287 0 ] "si-unit" "m" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0707378 -0.0779479 5.31818 ] "si-unit" "m" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.050029 0.3572283 -0.0658664 ] [ -0.2958236 -0.5766502 0.6976757 ] [ -3.7877978 3.639815 -3.4120831 ] [ 4.2381368 3.9534622 -5.0882975 ] [ -3.294744 -3.7269745 5.2252116 ] [ 0.5318193 -1.1126437 -0.1674414 ] [ -0.5047226 -0.3338386 -0.8271457 ] [ 5.1631609 -2.2003984 3.6379468 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.284508562822386e-09 5.723428352635421e-10 -1.055296070456976e-10 ] [ -4.739616597057624e-10 -9.238954764314267e-10 1.117799704649594e-09 ] [ -6.068721129476604e-09 5.83162654508271e-09 -5.466759816086285e-09 ] [ 6.790243752655531e-09 6.334144760242234e-09 -8.152351361340614e-09 ] [ -5.278761851811696e-09 -5.971271459413831e-09 8.371711933225754e-09 ] [ 8.520684559702361e-10 -1.782651738107306e-09 -2.682706986442476e-10 ] [ -8.086547563717284e-10 -5.348684044472723e-10 -1.325233513453573e-09 ] [ 8.27229575156241e-09 -3.525426901970985e-09 5.828633358695071e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.883649 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.588976733645746e-18 } }