{ "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" [ 5.42981 0 0 ] "si-unit" "m" "si-value" [ 5.42981e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0370196 5.47054 0 ] "si-unit" "m" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0339139 -0.0143321 5.52419 ] "si-unit" "m" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0865271 0.0202603 -0.0485063 ] [ 1.27669 1.31148 1.22292 ] [ -0.0137625 2.6467 2.79128 ] [ 1.29807 4.01993 4.311 ] [ 2.70854 -0.0697941 2.82717 ] [ 4.06866 1.27154 4.01384 ] [ 2.71531 2.7055 0.0603487 ] [ 4.06455 4.01651 1.33765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.65271e-12 2.02603e-12 -4.850630000000001e-12 ] [ 1.27669e-10 1.31148e-10 1.22292e-10 ] [ -1.37625e-12 2.6467e-10 2.79128e-10 ] [ 1.29807e-10 4.019929999999999e-10 4.311e-10 ] [ 2.70854e-10 -6.97941e-12 2.82717e-10 ] [ 4.06866e-10 1.27154e-10 4.01384e-10 ] [ 2.71531e-10 2.7055e-10 6.03487e-12 ] [ 4.06455e-10 4.016510000000001e-10 1.33765e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0731809 0.1087842 -0.9921662 ] [ 0.636652 1.7887576 1.8710718 ] [ 0.7376699 0.7730318 -0.706657 ] [ 0.8774697 -0.5885216 -2.6057973 ] [ -0.4164234 -1.5696349 -0.0833168 ] [ 0.6903997 -0.4630345 1.0018405 ] [ -0.3599956 -0.05377 0.0183606 ] [ -0.0925914 0.0043874000000000005 1.4966646 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.32160199603509e-09 1.742915033883828e-10 -1.589625502684571e-09 ] [ 1.020028958389368e-09 2.865905630609918e-09 2.99778751849632e-09 ] [ 1.181877477385116e-09 1.238533487298961e-09 -1.132189333652538e-09 ] [ 1.40586145038299e-09 -9.429155561242942e-10 -4.174947547000287e-09 ] [ -6.671838413308355e-10 -2.514832360690926e-09 -1.334882301796512e-10 ] [ 1.10614226746061e-09 -7.418630566358729e-10 1.605125440094877e-09 ] [ -5.767765386628104e-10 -8.614903761017998e-11 2.94169243062204e-11 ] [ -1.483477775893476e-10 7.0293897640116e-12 2.397921051054956e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.518388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.889584816094599e-18 } }