{ "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" [ [ -5.158713758260111e-09 -5.542206107902598e-09 -1.056151143425132e-09 ] [ -5.774340671960448e-11 -1.205225506889806e-09 -2.281133891314333e-09 ] [ -7.889002324102503e-10 7.056682784833248e-10 9.367074343855334e-10 ] [ 1.058479426490479e-09 4.063861878341893e-09 -3.538501915892751e-09 ] [ -9.145161666638189e-10 4.060989015443136e-11 2.672100555110515e-10 ] [ 1.571948674930691e-09 -3.755026152698823e-09 3.155356597706329e-09 ] [ 4.289445462632616e-09 5.69231788072924e-09 2.516512702811641e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.721427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.319938588901388e-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" [ [ -1.3490327147136e-13 4.96674752448e-14 3.172309709184e-14 ] [ 5.831922899712e-14 -1.2480955876032e-13 8.17110076608e-15 ] [ -6.360641184576e-14 -4.982769290688e-14 4.357920408576e-14 ] [ 6.665054742528e-14 2.7749699072256e-13 -6.777207105984e-14 ] [ -6.56892414528e-14 -1.698307218048e-14 -1.217654231808e-13 ] [ 1.3282044186432e-13 -7.241838326016e-14 1.4051088964416e-13 ] [ 6.24848882112e-15 -6.296554119743999e-14 -3.44467973472e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.385491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.586551032532881e-18 } }