{ "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" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.9479724 -0.9128592 2.9174826 ] [ -1.304775 -0.3406134 0.6592933 ] [ 1.6398347 -3.6060836 1.2144819 ] [ 0.5077492 0.824756 1.4315099 ] [ 1.1919632 0.2066782 -1.409829 ] [ -1.1187749 1.0347635 -4.9715359 ] [ -1.392567 -0.2951875 0.899454 ] [ -3.4714026 3.0885459 -0.7408566 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.325349130956901e-09 -1.462561680371933e-09 4.674322451821568e-09 ] [ -2.09048001762735e-09 -5.457228307072955e-10 1.056304320212752e-09 ] [ 2.6273048399624e-09 -5.777582884170602e-09 1.945814522595924e-09 ] [ 8.135039041721927e-10 1.321404791951304e-09 2.293531713119677e-09 ] [ 1.909735587627869e-09 3.311349827971788e-10 -2.258795081735586e-09 ] [ -1.792475003485686e-09 1.657873901416059e-09 -7.96527865407216e-09 ] [ -2.231138308679478e-09 -4.729425151488749e-10 1.441084182157836e-09 ] [ -5.561800132926848e-09 4.9483960740165e-09 -1.186983133664684e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.874802 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.587559287977646e-18 } }