{ "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" [ 5.40836 0 0 ] "si-unit" "m" "si-value" [ 5.40836e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0676972 5.56169 0 ] "si-unit" "m" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0290382 0.0456166 5.46301 ] "si-unit" "m" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9001452 -0.684253 -1.5650073 ] [ 1.8580538 -0.2690174 -0.4905151 ] [ -4.110594 -0.119707 0.5215545 ] [ 2.5147087 2.6670711 0.0468891 ] [ 0.0615026 -1.8157314 0.7985657 ] [ 3.3310326 -2.5712812 -3.0082585 ] [ -2.8262046 0.6712409 0.601854 ] [ 2.0716462 2.1216781 3.0949175 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.646544874647257e-09 -1.096294168344402e-09 -2.507418128099428e-09 ] [ 2.976930383074909e-09 -4.310133924194315e-10 -7.858918318441733e-10 ] [ -6.585897658660595e-09 -1.91791758326238e-10 8.35622433257553e-10 ] [ 4.029007520456515e-09 4.273118997636677e-09 7.51246204092894e-11 ] [ 9.853802865024839e-11 -2.909122422700107e-09 1.279443305253854e-09 ] [ 5.336902598812268e-09 -4.119646658083481e-09 -4.819761477731889e-09 ] [ -4.528078973023316e-09 1.07544648576513e-09 9.642764158794358e-10 ] [ 3.31914313555489e-09 3.399303076689515e-09 4.958604502657695e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.985381 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.605275996978754e-18 } }