{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.40836e-10 0.0 0.0 ] "source-value" [ 5.40836 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] "source-value" [ 0.0676972 5.56169 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] "source-value" [ 0.0290382 0.0456166 5.46301 ] } "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" [ [ -4.64654483636534e-09 -1.096294159312262e-09 -2.507418107441332e-09 ] [ 2.976930358548599e-09 -4.31013388868402e-10 -7.858918253693741e-10 ] [ -6.585897604400755e-09 -1.917917567461056e-10 8.356224263730337e-10 ] [ 4.029007487262361e-09 4.273118962431339e-09 7.512461979035328e-11 ] [ 9.853802783841408e-11 -2.909122398732453e-09 1.279443294712787e-09 ] [ 5.336902554842638e-09 -4.119646624142569e-09 -4.819761438022878e-09 ] [ -4.528078935717416e-09 1.075446476904751e-09 9.642764079349633e-10 ] [ 3.319143108209161e-09 3.399303048683365e-09 4.958604461804785e-09 ] ] "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 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.605275950798052e-18 "source-value" -34.985381 } }