{ "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" [ [ 0.7481215 0.3697243 2.264709 ] [ 0.2413431 2.204484 1.035234 ] [ 2.632044 0.6504598 2.339521 ] [ 2.588426 1.874203 0.0457334 ] [ 2.842468 2.848588 2.160611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481215e-11 3.697243e-11 2.264709e-10 ] [ 2.413431e-11 2.204484e-10 1.035234e-10 ] [ 2.632044e-10 6.504598e-11 2.339521e-10 ] [ 2.588426e-10 1.874203e-10 4.57334e-12 ] [ 2.842468e-10 2.848588e-10 2.160611e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -186.2630012 -32.5936588 -3.7543605 ] [ -2.0488033 5.254128 -4.035587 ] [ 186.8649815 13.0296487 5.4339807 ] [ -1.4714625 -7.3483872 -8.8311756 ] [ 2.9182855 21.6582694 11.1871424 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.984262283013539e-07 -5.222079854592847e-08 -6.015148668712557e-09 ] [ -3.282544774922092e-09 8.418041113645151e-09 -6.465723195874156e-09 ] [ 2.993907070721423e-07 2.087579869636847e-08 8.706196907146963e-09 ] [ -2.357542835307224e-09 -1.177341426942468e-08 -1.414910319707093e-08 ] [ 4.675608839441007e-09 3.470037316555719e-08 1.792377815451068e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 17.970448 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.879183188811203e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3281726 0.2647057 2.467921 ] [ -0.0829069 1.8099466 0.5078994 ] [ 2.8388615 0.5851095 2.2681879 ] [ 2.4090433 2.2007886 0.2188961 ] [ 3.559232 3.0869086 2.382904 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.281726e-11 2.647057e-11 2.467921e-10 ] [ -8.29069e-12 1.8099466e-10 5.078994e-11 ] [ 2.8388615e-10 5.851094999999999e-11 2.2681879e-10 ] [ 2.4090433e-10 2.2007886e-10 2.188961e-11 ] [ 3.559232e-10 3.0869086e-10 2.382904e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-05 8.9e-06 9.1e-06 ] [ -3.16e-05 3.42e-05 -2.42e-05 ] [ 2.28e-05 -1.35e-05 7.6e-06 ] [ -6.2e-06 -2.92e-05 -1.71e-05 ] [ -2e-05 -4e-07 2.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.607618218999999e-14 1.42593720426e-14 1.45798073694e-14 ] [ -5.06287816344e-14 5.479444088279999e-14 -3.877267454279999e-14 ] [ 3.65296272552e-14 -2.162938455899999e-14 1.21765424184e-14 ] [ -9.9334951308e-15 -4.67835577128e-14 -2.73972204414e-14 ] [ -3.204353268e-14 -6.408706536e-16 3.94135451964e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.178089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.592015617857242e-18 } }