{ "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" [ [ -1.694479 -0.2180784 -3.588901 ] [ 2.8764633 0.9663306 2.9228188 ] [ 0.4884218 0.7661151 -1.9244661 ] [ -1.3258243 -1.4510892 0.338585 ] [ 0.0104667 2.9438923 -1.4537494 ] [ -0.6278769 -1.4214256 3.3738557 ] [ -0.3581157 -0.75817 -2.4825642 ] [ 0.630944 -0.8275749 2.8144213 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.714854638236563e-09 -3.494001139814707e-10 -5.750053276565741e-09 ] [ 4.608602249849217e-09 1.548232295283637e-09 4.682871948194711e-09 ] [ 7.825379890490534e-10 1.227451702061854e-09 -3.083334592942155e-09 ] [ -2.124204696748525e-09 -2.324901190935376e-09 5.424729711535681e-10 ] [ 1.676950203692736e-11 4.71663541721314e-09 -2.329163301182028e-09 ] [ -1.00596968992038e-09 -2.277374864526613e-09 5.405512724492819e-09 ] [ -5.737646020814266e-10 -1.214722248591936e-09 -3.977506320875056e-09 ] [ 1.010883725834035e-09 -1.325921156740898e-09 4.509200007941543e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.779278 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.732472272070379e-18 } }