{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6558612 -6.6936276 1.6560273 ] [ -3.0890165 1.4624102 -7.47456 ] [ -3.4770899 5.227791 5.7315457 ] [ 4.8336514 -5.450712 1.5096071 ] [ 2.3883162 5.4541385 -1.4226201 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.050805481129833e-09 -1.072437364906161e-08 2.653248223466548e-09 ] [ -4.949150017565443e-09 2.343039432459452e-09 -1.197556528276685e-08 ] [ -5.57091214619981e-09 8.375844518628653e-09 9.18294852158677e-09 ] [ 7.74436326617719e-09 -8.733003333114011e-09 2.418657202213688e-09 ] [ 3.826504378717897e-09 8.73849319130518e-09 -2.279288664500158e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.3409752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.352832356112604e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1440483 0.1010623 2.3161308 ] [ 0.2394869 1.5074881 0.241006 ] [ 0.1840604 2.3544668 3.4178826 ] [ 2.6234495 0.4786631 2.2587181 ] [ 1.887271 2.7926945 1.6289365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.440483e-11 1.010623e-11 2.3161308e-10 ] [ 2.394869e-11 1.5074881e-10 2.41006e-11 ] [ 1.840604e-11 2.3544668e-10 3.4178826e-10 ] [ 2.6234495e-10 4.786631e-11 2.2587181e-10 ] [ 1.887271e-10 2.7926945e-10 1.6289365e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.05e-05 -2.92e-05 9.7e-06 ] [ -5.9e-06 1.14e-05 5.3e-06 ] [ -5.4e-06 4e-06 -1.18e-05 ] [ 4e-06 4.7e-06 -9e-07 ] [ 1.77e-05 9e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.68228545184e-14 -4.678355732736e-14 1.554111322176e-14 ] [ -9.45284206272e-15 1.826481347712e-14 8.491536090240001e-15 ] [ -8.65175375232e-15 6.4087064832e-15 -1.890568412544e-14 ] [ 6.4087064832e-15 7.53023011776e-15 -1.44195895872e-15 ] [ 2.835852618816e-14 1.44195895872e-14 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }