{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0994291 -0.1506498 -2.0612334 ] [ 1.7077065 0.5989215 1.6468956 ] [ 0.4969859 0.8179539 -1.0125296 ] [ -0.8545764 -0.8806346 0.2125615 ] [ -0.0031753 1.6646939 -0.8275723 ] [ -0.4877499 -1.0093778 1.8520708 ] [ -0.2239386 -0.5451145 -1.1614113 ] [ 0.4641769 -0.4957925 1.3512186 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.761479600247185e-09 -2.413675874881958e-10 -3.302459963492095e-09 ] [ 2.736047429488195e-09 9.595780249944673e-10 2.638617627218389e-09 ] [ 7.962591898472467e-10 1.310506615472181e-09 -1.622251252987976e-09 ] [ -1.369182328767429e-09 -1.41093216758756e-09 3.405610657821792e-10 ] [ -5.087391424026239e-12 2.667133647368373e-09 -1.325916991081684e-09 ] [ -7.81461486577538e-10 -1.617201512714538e-09 2.967344535826352e-09 ] [ -3.587891894146828e-10 -8.733697075590815e-10 -1.860786031992935e-09 ] [ 7.436933770954195e-10 -7.94347152267984e-10 2.164890850510107e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.646688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.109052391455192e-18 } }