{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9310251 0.4264222 0.0309113 ] [ -7.4250947 -4.1970664 3.1130936 ] [ 0.9311515 -1.1638868 -2.3941449 ] [ 0.8817485 2.5420429 1.9878977 ] [ 1.2028608 -2.3473778 3.6533124 ] [ -0.7494907 -1.4876985 1.6170426 ] [ 3.0291299 3.4688365 -7.6675268 ] [ 1.1986697 2.7587279 -0.340586 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.491666648597982e-09 6.832036794301016e-10 4.952536217853504e-11 ] [ -1.189631313556599e-08 -6.724441662025221e-09 4.987725784282107e-09 ] [ 1.491869163722851e-09 -1.864752220217725e-09 -3.835842985587554e-09 ] [ 1.412716832125469e-09 4.072801703450633e-09 3.184963219482092e-09 ] [ 1.927195451836785e-09 -3.760913831344938e-09 5.853251715758738e-09 ] [ -1.200816477047026e-09 -2.383555755499229e-09 2.590787848557646e-09 ] [ 4.853201107146242e-09 5.5576887416777e-09 -1.228473217831744e-08 ] [ 1.92048056940135e-09 4.41996934452868e-09 -5.456789265717888e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.107876 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.381854544194542e-18 } }