{ "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" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.9510769999999997 -2.7884139999999995 7.491463799999999 ] [ -3.1907526999999996 1.6435708999999998 3.3811905999999996 ] [ 2.5635197999999995 -7.1352006999999995 -4.906053599999999 ] [ 4.321818999999999 -0.32766989999999996 1.6721893999999997 ] [ -1.5743214999999997 2.4788896999999994 1.0074294999999998 ] [ -5.452102299999999 5.453206999999999 -3.6114774999999995 ] [ -0.47532269999999993 -0.6755559999999999 -1.2478785999999997 ] [ -0.14391659999999998 1.3511730999999998 -3.7868635999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.330323196380601e-09 -4.467531719911411e-09 1.200264815592953e-08 ] [ -5.112149378694475e-09 2.633290870607215e-09 5.417264529788724e-09 ] [ 4.107211490517891e-09 -1.143185174625579e-08 -7.860364378311673e-09 ] [ 6.924317361129233e-09 -5.249850531198738e-10 2.679142762229579e-09 ] [ -2.522341100922787e-09 3.971619122881925e-09 1.614079992004233e-09 ] [ -8.735230839269906e-09 8.737000763782904e-09 -5.786224817045231e-09 ] [ -7.615509172755321e-10 -1.082360029241165e-09 -1.999321918516634e-09 ] [ -2.305798118650252e-10 2.16481795147386e-09 -6.067224326078523e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.230517 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.163898081369695e-18 } }