{ "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" [ 5.37283 0 0 ] "si-unit" "m" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.256601 5.36059 0 ] "si-unit" "m" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0433697 -0.246629 5.47376 ] "si-unit" "m" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.954994 2.6160982 -3.5612755 ] [ 0.5293384 0.7563424 0.4222405 ] [ 0.468677 1.4802082 -1.391044 ] [ -0.8030046 -1.2707248 1.0300064 ] [ 1.0000909 0.6825318 0.6738645 ] [ -0.1741763 -2.269285 -0.3092045 ] [ -1.1474847 0.7588174 0.6537623 ] [ -1.8284346 -2.7539882 2.4816503 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.132245680604275e-09 4.191451373756963e-09 -5.70579234632783e-09 ] [ 8.480936089716787e-10 1.211794110599762e-09 6.765038574549025e-10 ] [ 7.509033321066816e-10 2.371554971956451e-09 -2.228698175304115e-09 ] [ -1.286555196514856e-09 -2.035925566030756e-09 1.650252173354373e-09 ] [ 1.602322258654831e-09 1.093536492912542e-09 1.079649947487082e-09 ] [ -2.790611957574471e-10 -3.635795372932128e-09 -4.954002209461536e-10 ] [ -1.838473159065702e-09 1.215759497736242e-09 1.047442672620436e-09 ] [ -2.929475168781799e-09 -4.412375507999075e-09 3.976042091661306e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.938263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.757944477076167e-18 } }