{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4921224 -4.9297389 -11.8454846 ] [ 7.6753969 -6.6169487 2.7790996 ] [ -3.7105857 -5.4423048 11.1058516 ] [ -3.651943 8.976546 0.8511953 ] [ 6.1792541 8.0124465 -2.8906619 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.040152672865199e-08 -7.89831241222831e-09 -1.897855848816644e-08 ] [ 1.22973414685408e-08 -1.060152050817295e-08 4.452608405994632e-09 ] [ -5.945013658014803e-09 -8.71953351382762e-09 1.779353578759427e-08 ] [ -5.851057695094214e-09 1.438201213673576e-08 1.363765209394842e-09 ] [ 9.900256453002544e-09 1.283735445771078e-08 -4.631350914817307e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4225408 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.029004471589413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.881655 2.080502 0.9241573 ] [ 2.9709686 1.5709983 2.448889 ] [ 0.7959707 1.9316039 3.5547758 ] [ 0.6400118 4.1650169 2.5198117 ] [ 2.8150056 3.8044199 1.4139451 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.81655e-11 2.080502e-10 9.241572999999999e-11 ] [ 2.9709686e-10 1.5709983e-10 2.448889e-10 ] [ 7.959707e-11 1.9316039e-10 3.5547758e-10 ] [ 6.400118000000001e-11 4.1650169e-10 2.5198117e-10 ] [ 2.8150056e-10 3.8044199e-10 1.4139451e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.15e-05 -6.7e-06 7.6e-06 ] [ -3.28e-05 8.3e-06 2.31e-05 ] [ 1.9e-05 4.2e-06 -2.5e-05 ] [ -1.18e-05 -2.97e-05 1.62e-05 ] [ 4.7e-05 2.39e-05 -2.18e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.44467973472e-14 -1.073458335936e-14 1.217654231808e-14 ] [ -5.255139316223999e-14 1.329806595264e-14 3.701027994048e-14 ] [ 3.04413557952e-14 6.72914180736e-15 -4.005441552e-14 ] [ -1.890568412544e-14 -4.758464563776e-14 2.595526125696e-14 ] [ 7.530230117759999e-14 3.829202123712e-14 -3.492745033344e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }