{ "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" [ [ -12.6793903 5.2052572 4.2407518 ] [ 0.2108658 0.8042307 0.7505115 ] [ -4.5984655 2.8159276 -4.4534255 ] [ 9.6053457 -1.8657762 -7.8996602 ] [ -3.6592157 0.8033381 8.6642498 ] [ 1.974546 -5.0388922 0.6474965 ] [ -6.8430295 -5.6383524 -6.0745505 ] [ 15.9893434 2.9142672 4.1246266 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.031462270465829e-08 8.33974139109087e-09 6.794433388575518e-09 ] [ 3.378442548862886e-10 1.288519625269619e-09 1.202451978941539e-09 ] [ -7.367553915655382e-09 4.511613366585454e-09 -7.13517421857455e-09 ] [ 1.538946031524181e-08 -2.989303007285065e-09 -1.265665088470425e-08 ] [ -5.862709845004307e-09 1.287089522417892e-09 1.388165846633108e-08 ] [ 3.163571437894156e-09 -8.073195277571479e-09 1.037403754349827e-09 ] [ -1.096374188034471e-08 -9.03363639511157e-09 -9.73250279296895e-09 ] [ 2.561775217742278e-08 4.669170774604277e-09 6.608380308049793e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.704617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.239857274961824e-18 } }