{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3638957 2.161813 -1.0243667 ] [ 4.4040658 0.8848024 1.088192 ] [ -18.3554199 50.1321519 -13.5734537 ] [ 18.9384667 -58.8390342 -14.343336 ] [ -7.3510083 5.6602668 27.8529644 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.787378455753074e-09 3.463606275677442e-09 -1.641216391387688e-09 ] [ 7.056091319358516e-09 1.417609730987121e-09 1.743475795705728e-09 ] [ -2.940862487103861e-08 8.03205623863187e-08 -2.174707036082084e-08 ] [ 3.034276883052708e-08 -9.427052576236688e-08 -2.298055779281102e-08 ] [ -1.177761373460006e-08 9.06874720916595e-09 4.462536874931383e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.80754514 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.293829954208259e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9469648 0.3501596 2.5843144 ] [ 0.4657474 1.6150968 0.6990229 ] [ 2.2005323 3.1539111 0.7914558 ] [ 2.6044746 0.8410843 0.9839851 ] [ 2.40439 2.1340949 2.8661518 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.469648e-11 3.501596e-11 2.5843144e-10 ] [ 4.657474e-11 1.6150968e-10 6.990229e-11 ] [ 2.2005323e-10 3.1539111e-10 7.914558000000001e-11 ] [ 2.6044746e-10 8.410843e-11 9.839851e-11 ] [ 2.40439e-10 2.1340949e-10 2.8661518e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.12e-05 3.62e-05 2.3e-06 ] [ -0.0001298 -3.01e-05 -0.0001878 ] [ -8.03e-05 -1.15e-05 1.35e-05 ] [ 5.8e-05 -3.1e-05 -2.33e-05 ] [ 0.0002034 3.65e-05 0.0001953 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.20314436608e-14 5.799879415079998e-14 3.685006258199999e-15 ] [ -2.079625270932e-13 -4.82255166834e-14 -3.008887718652e-13 ] [ -1.286547837102e-13 -1.8425031291e-14 2.162938455899999e-14 ] [ 9.292624477199999e-14 -4.966747565399999e-14 -3.733071557219999e-14 ] [ 3.258827273556e-13 5.847944714099999e-14 3.129050966202e-13 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247335191657e-18 } }