{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3343326 -2.8204792 -5.7101017 ] [ -0.646583 0.0544598 0.4595815 ] [ -5.3609301 2.9033105 1.3251046 ] [ 7.2755315 -11.2508036 -6.0134904 ] [ -4.8696874 -7.5321059 6.7643071 ] [ -1.5357999 10.2103078 -5.2095586 ] [ 10.4718015 8.4353106 8.3841576 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.546542979291277e-09 -4.518905833692687e-09 -9.148591446130336e-09 ] [ -1.035940166006726e-09 8.725421833344385e-11 7.363307346521952e-10 ] [ -8.589156871963006e-09 4.651616206023159e-09 2.123051610234536e-09 ] [ 1.165668647319395e-08 -1.802577449313248e-08 -9.634673728285241e-09 ] [ -7.802099302884339e-09 -1.206776397836974e-08 1.083761469153145e-08 ] [ -2.460622694006978e-09 1.635871644833189e-08 -8.346632993607579e-09 ] [ 1.677767554095837e-08 1.351485743250642e-08 1.343290129182264e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6957275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.393209130134763e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1713461 3.0953665 0.9877374 ] [ 0.8246803 2.8387733 1.8969687 ] [ 1.8790029 4.1034086 3.8170718 ] [ 4.6355144 2.0570154 2.6777853 ] [ 3.159866 2.1485315 4.685273 ] [ 3.5584158 5.1244912 2.3287184 ] [ 5.7876958 4.2580665 3.1527195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1713461e-10 3.0953665e-10 9.877374e-11 ] [ 8.246803e-11 2.8387733e-10 1.8969687e-10 ] [ 1.8790029e-10 4.1034086e-10 3.8170718e-10 ] [ 4.6355144e-10 2.0570154e-10 2.6777853e-10 ] [ 3.159866e-10 2.1485315e-10 4.685273e-10 ] [ 3.5584158e-10 5.124491199999999e-10 2.3287184e-10 ] [ 5.7876958e-10 4.2580665e-10 3.1527195e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.2e-06 1.99e-05 -9e-07 ] [ -3.2e-06 -5.5e-06 -1.03e-05 ] [ -5.3e-06 -1e-07 8.4e-06 ] [ 1.08e-05 -3e-05 1.65e-05 ] [ 1.67e-05 3.24e-05 -1.78e-05 ] [ -2.78e-05 5e-06 9.1e-06 ] [ 1.7e-06 -2.16e-05 -4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.153567166976e-14 3.188331475392e-14 -1.44195895872e-15 ] [ -5.126965186560001e-15 -8.8119714144e-15 -1.650241919424e-14 ] [ -8.491536090240001e-15 -1.6021766208e-16 1.345828361472e-14 ] [ 1.730350750464e-14 -4.8065298624e-14 2.64359142432e-14 ] [ 2.675634956736e-14 5.191052251392001e-14 -2.851874385024e-14 ] [ -4.454051005824e-14 8.010883104e-15 1.457980724928e-14 ] [ 2.72370025536e-15 -3.460701500928e-14 -7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735010429801e-18 } }