{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] "source-value" [ 5.4419 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] "source-value" [ 0.361794 5.44502 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] "source-value" [ 0.0366443 0.298499 5.53333 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 6.607956692551255e-09 -4.856415073447567e-09 1.219225598572382e-08 ] [ -3.265529471947331e-09 1.13996404659476e-09 3.614667950486625e-09 ] [ 2.829803120331183e-09 -1.055444871927151e-08 -5.893264474686598e-09 ] [ 7.920039369165316e-09 6.116197097540544e-11 3.180330686000711e-09 ] [ -3.067888488794008e-09 4.211261486584844e-09 1.368569015556987e-09 ] [ -9.053464292099943e-09 8.628542859396808e-09 -5.51104313175739e-09 ] [ -1.675137340846301e-09 -1.44097378031587e-09 -2.453923673120089e-09 ] [ -2.95779748577833e-10 2.810907369700792e-09 -6.497592358204066e-09 ] ] "source-value" [ [ 4.124362199999999 -3.0311358999999998 7.609807699999999 ] [ -2.0381831999999998 0.7115095999999999 2.2560982999999997 ] [ 1.7662241999999997 -6.587568799999999 -3.6782863999999997 ] [ 4.943299799999999 0.038174299999999994 1.9850062999999998 ] [ -1.9148253999999998 2.6284626999999996 0.8541935999999999 ] [ -5.650727999999999 5.385512899999999 -3.4397225999999996 ] [ -1.0455384999999997 -0.8993850999999999 -1.5316186999999999 ] [ -0.18461119999999998 1.7544303999999997 -4.055478199999999 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.098964426411265e-18 "source-value" -31.825233 } }