{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2198159 -3.459173 -0.6591977 ] [ -0.0360406 -0.7522426 -1.4237718 ] [ -0.4923928 0.4404435 0.5846468 ] [ 0.6606509 2.5364631 -2.2085592 ] [ -0.5707961 0.0253467 0.1667794 ] [ 0.9811332 -2.343703 1.9694187 ] [ 2.6772613 3.5528654 1.5706837 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.15871380076168e-09 -5.542206153563681e-09 -1.056151152126542e-09 ] [ -5.774340719534039e-11 -1.205225516819408e-09 -2.281133910108121e-09 ] [ -7.889002389098352e-10 7.056682842971789e-10 9.36707442102871e-10 ] [ 1.058479435211071e-09 4.063861911823205e-09 -3.538501945045732e-09 ] [ -9.145161741983273e-10 4.06098904890078e-11 2.672100577125396e-10 ] [ 1.571948687881649e-09 -3.755026183635702e-09 3.155356623702656e-09 ] [ 4.289445497972464e-09 5.692317927627063e-09 2.516512723544666e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.721427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.319938616253671e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7072421 1.6381084 3.4092221 ] [ 2.724262 3.6632075 1.9472291 ] [ 5.2094172 0.4203495 1.934707 ] [ 5.106848 2.870165 1.9874238 ] [ 3.2210178 1.4265934 0.9799178 ] [ 5.0835745 1.4367457 4.1322025 ] [ 3.9903225 3.670106 4.0899708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7072421e-10 1.6381084e-10 3.4092221e-10 ] [ 2.724262e-10 3.6632075e-10 1.9472291e-10 ] [ 5.2094172e-10 4.203495e-11 1.934707e-10 ] [ 5.106848e-10 2.870165e-10 1.9874238e-10 ] [ 3.2210178e-10 1.4265934e-10 9.799178e-11 ] [ 5.0835745e-10 1.4367457e-10 4.1322025e-10 ] [ 3.9903225e-10 3.670106e-10 4.0899708e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.42e-05 3.1e-05 1.98e-05 ] [ 3.64e-05 -7.79e-05 5.1e-06 ] [ -3.97e-05 -3.11e-05 2.72e-05 ] [ 4.16e-05 0.0001732 -4.23e-05 ] [ -4.1e-05 -1.06e-05 -7.6e-05 ] [ 8.29e-05 -4.52e-05 8.77e-05 ] [ 3.9e-06 -3.93e-05 -2.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.349032725828e-13 4.966747565399999e-14 3.17230973532e-14 ] [ 5.831922947759999e-14 -1.248095597886e-13 8.1711008334e-15 ] [ -6.36064123698e-14 -4.982769331739999e-14 4.35792044448e-14 ] [ 6.665054797439999e-14 2.774969930088e-13 -6.77720716182e-14 ] [ -6.568924199399999e-14 -1.69830723204e-14 -1.21765424184e-13 ] [ 1.328204429586e-13 -7.24183838568e-14 1.405108908018e-13 ] [ 6.248488872599999e-15 -6.29655417162e-14 -3.4446797631e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.385491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.586551062081729e-18 } }