{ "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" [ [ -0.446933 -0.1399193 -0.605792 ] [ 0.0549658 -0.533034 0.1923753 ] [ -1.8165775 0.4149842 0.1767591 ] [ 0.1239779 1.286857 -0.5421688 ] [ 1.1490173 -1.2487593 0.8948834 ] [ 1.3730534 -1.4242385 -1.431763 ] [ -0.637568 0.4517674 0.2154567 ] [ 0.2000642 1.1923425 1.1002492 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.160656036640064e-10 -2.241754312587015e-10 -9.705857794676736e-10 ] [ 8.806491970356865e-11 -8.540146128915072e-10 3.082192080793862e-10 ] [ -2.910478000371312e-09 6.648779832413915e-10 2.831992975336493e-10 ] [ 1.986344928758803e-10 2.061772199712826e-09 -8.686501758871912e-10 ] [ 1.84092865495474e-09 -2.000732955466573e-09 1.433761261822015e-09 ] [ 2.199874056589951e-09 -2.281881627143261e-09 -2.29393720512647e-09 ] [ -1.021496543770215e-09 7.238111663196019e-10 3.451996875347194e-10 ] [ 3.205381838990554e-10 1.910343277486224e-09 1.762793545293903e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 636.18926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.019287558776053e-16 } }