{ "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" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.7053095 -15.940708 -30.3979192 ] [ -14.7853015 -45.2986998 74.3476078 ] [ 7.726823 31.9776624 6.7834699 ] [ 19.2150719 25.8098552 -81.9514989 ] [ 8.5487162 3.4518901 31.2183405 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.317356280732813e-08 -2.553982967659953e-08 -4.870283546320744e-08 ] [ -2.368866439477917e-08 -7.257651777219764e-08 1.191179990295677e-07 ] [ 1.237973516365972e-08 5.123386308511522e-08 1.086831688168051e-08 ] [ 3.078593896517104e-08 4.135194658767331e-08 -1.313007755770969e-07 ] [ 1.369655323349422e-08 5.530537615790974e-09 5.001729528927378e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 30.678376 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.915217679131182e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3638821 3.0992973 -0.0249905 ] [ 3.6500262 0.5063427 2.920555 ] [ 1.9155398 4.6639283 2.2519442 ] [ 2.7766384 0.6775537 0.247799 ] [ 3.2820535 3.0371916 4.1025958 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3638821e-10 3.0992973e-10 -2.49905e-12 ] [ 3.6500262e-10 5.063427000000001e-11 2.920555e-10 ] [ 1.9155398e-10 4.663928300000001e-10 2.2519442e-10 ] [ 2.7766384e-10 6.775537000000001e-11 2.47799e-11 ] [ 3.2820535e-10 3.0371916e-10 4.1025958e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.69e-05 -2.51e-05 1.65e-05 ] [ -4.34e-05 -2.51e-05 -2.95e-05 ] [ 4.56e-05 -2.68e-05 2.03e-05 ] [ 5.12e-05 2.88e-05 1.57e-05 ] [ -1.66e-05 4.82e-05 -2.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.912031730752001e-14 -4.021463318208e-14 2.64359142432e-14 ] [ -6.953446534272e-14 -4.021463318208e-14 -4.72642103136e-14 ] [ 7.305925390848e-14 -4.293833343744e-14 3.252418540224e-14 ] [ 8.203144298496001e-14 4.614268667904e-14 2.515417294656e-14 ] [ -2.659613190528e-14 7.722491312256001e-14 -3.68500622784e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.190057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.953062433161938e-18 } }