{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7763658 10.9520344 9.1510539 ] [ -5.3877031 -4.9785747 4.2430242 ] [ 1.037447 0.5652861 -1.3919843 ] [ 11.243684 -9.9503769 -8.8951247 ] [ -8.2913092 -6.4782689 -4.5648277 ] [ 7.483213 6.7600179 7.7686046 ] [ 3.7646414 3.8771094 -5.6148066 ] [ 1.9263928 -0.7472273 -0.6959397 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.886781796274869e-08 1.754709346587736e-08 1.466160461426066e-08 ] [ -8.632051946631686e-09 -7.976555989246374e-09 6.798074174728623e-09 ] [ 1.662173328719098e-09 9.056881734832109e-10 -2.230204701980654e-09 ] [ 1.801436763646302e-08 -1.594226123732838e-08 -1.425156083344061e-08 ] [ -1.328414175606395e-08 -1.037933097483573e-08 -7.313660218920236e-09 ] [ 1.198942891706663e-08 1.083074263556951e-08 1.244667666635934e-08 ] [ 6.031620436775781e-09 6.211814036963916e-09 -8.995911864833538e-09 ] [ 3.08642150663745e-09 -1.197190110483508e-09 -1.115018316826566e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.895194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.668214455548044e-18 } }