{ "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" [ [ 1.724599 2.153048 2.374712 ] [ 0.8645185 3.613019 0.4039649 ] [ 2.279761 4.306527 2.243044 ] [ 4.11856 1.980977 2.568835 ] [ 3.209467 2.952847 0.6643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724599e-10 2.153048e-10 2.374712e-10 ] [ 8.645185e-11 3.613019e-10 4.039649e-11 ] [ 2.279761e-10 4.306527e-10 2.243044e-10 ] [ 4.118560000000001e-10 1.980977e-10 2.568835e-10 ] [ 3.209467e-10 2.952847e-10 6.643367000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6330512 -6.6374324 5.9925126 ] [ -4.8510134 1.4404711 -4.2328964 ] [ -0.6537869 8.3126044 4.1100244 ] [ 3.384345 -2.6628272 1.6999718 ] [ 6.7535065 -0.4528159 -7.5696125 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.422966315609385e-09 -1.063433901342043e-08 9.601063587569422e-09 ] [ -7.77218025666752e-09 2.307889119358059e-09 -6.781847650348485e-09 ] [ -1.047482086165308e-09 1.331826042763921e-08 6.584985004597549e-09 ] [ 5.422318435721376e-09 -4.266319485070326e-09 2.723655073979294e-09 ] [ 1.082031022272084e-08 -7.254910485065107e-10 -1.212785617601544e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.4135343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.469084849758893e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2113784 2.4965443 3.4762668 ] [ 1.7981958 4.1609009 0.2789024 ] [ 1.0330081 4.0609011 2.384292 ] [ 3.704842 1.6297214 2.0457556 ] [ 3.4494813 2.6583503 0.0696758 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2113784e-10 2.4965443e-10 3.4762668e-10 ] [ 1.7981958e-10 4.1609009e-10 2.789024e-11 ] [ 1.0330081e-10 4.0609011e-10 2.384292e-10 ] [ 3.704842e-10 1.6297214e-10 2.0457556e-10 ] [ 3.4494813e-10 2.6583503e-10 6.96758e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 5e-07 -3e-07 ] [ -0.0 0.0 3e-07 ] [ -3e-07 0.0 1e-07 ] [ 6e-07 -5e-07 -3e-07 ] [ -0.0 -1e-07 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-16 8.010883104e-16 -4.8065298624e-16 ] [ 0.0 0.0 4.8065298624e-16 ] [ -4.8065298624e-16 0.0 1.6021766208e-16 ] [ 9.6130597248e-16 -8.010883104e-16 -4.8065298624e-16 ] [ 0.0 -1.6021766208e-16 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -8.9680601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.436841622614931e-18 } }