{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2455018 0.983842 -2.189129 ] [ -0.8000863 0.1792401 0.7531513 ] [ -0.0248745 -0.3710982 -1.3596964 ] [ -1.2854345 -1.0411671 2.8568816 ] [ 2.5358781 1.2794008 -1.8463094 ] [ -0.5020203 -1.278955 0.2337726 ] [ 0.1405012 0.8574497 -0.2923577 ] [ -1.3094656 -0.6087123 1.843687 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.995513865124317e-09 1.576288650961114e-09 -3.507371303715283e-09 ] [ -1.281879564482375e-09 2.871742977298541e-10 1.206681404785127e-09 ] [ -3.98533423540896e-11 -5.945648600609626e-10 -2.178473783465925e-09 ] [ -2.059493103469738e-09 -1.668133585966136e-09 4.577228907913697e-09 ] [ 4.062924605018724e-09 2.049826050392817e-09 -2.958113755443276e-09 ] [ -8.043251878270021e-10 -2.049111800055264e-09 3.745449943036301e-10 ] [ 2.25107737834345e-10 1.373785862851974e-09 -4.684086718508602e-10 ] [ -2.097995170061845e-09 -9.752646158533958e-10 2.95391220747289e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.689405 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.878290692206263e-18 } }