{ "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" [ [ -8.546543049704466e-09 -4.518905870923012e-09 -9.148591521503677e-09 ] [ -1.035940174541622e-09 8.72542190523132e-11 7.363307407186708e-10 ] [ -8.589156942727282e-09 4.651616244346856e-09 2.123051627725916e-09 ] [ 1.165668656923097e-08 -1.802577464164308e-08 -9.634673807663314e-09 ] [ -7.802099367164212e-09 -1.206776407779354e-08 1.08376147808203e-08 ] [ -2.460622714279536e-09 1.635871658310794e-08 -8.346633062373752e-09 ] [ 1.677767567918615e-08 1.351485754385252e-08 1.343290140249352e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6957275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.393209141613124e-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" [ [ 1.15356717648e-14 3.18833150166e-14 -1.4419589706e-15 ] [ -5.1269652288e-15 -8.811971486999999e-15 -1.65024193302e-14 ] [ -8.4915361602e-15 -1.602176634e-16 1.34582837256e-14 ] [ 1.73035076472e-14 -4.806529901999999e-14 2.6435914461e-14 ] [ 2.67563497878e-14 5.19105229416e-14 -2.851874408519999e-14 ] [ -4.454051042519999e-14 8.010883169999999e-15 1.45798073694e-14 ] [ 2.7237002778e-15 -3.46070152944e-14 -7.850665506599998e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }