{ "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" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.6411649 -17.9638653 -9.2197959 ] [ -11.2709479 -9.5466073 11.4201498 ] [ -5.8090003 8.6924452 -8.9550889 ] [ -6.1484591 14.1928992 3.0094117 ] [ 20.6680617 -6.9513912 4.067596 ] [ 8.527047 5.8481146 -5.3491432 ] [ 3.6744635 5.7284048 5.0268704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.544684900005757e-08 -2.878128500286038e-08 -1.477174143952769e-08 ] [ -1.805804921963486e-08 -1.529535102401861e-08 1.82970970155938e-08 ] [ -9.307044470880186e-09 1.392683247702518e-08 -1.434763407276559e-08 ] [ -9.85091742396501e-09 2.273953127961102e-08 4.821609068101983e-09 ] [ 3.31138852529919e-08 -1.113735646267486e-08 6.517007214059597e-09 ] [ 1.366183534786278e-08 9.369712487879144e-09 -8.570272176351299e-09 ] [ 5.88713951368294e-09 9.177916245038501e-09 8.053934230671544e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.93080113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.491307809100221e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7109724 1.8794556 1.7308178 ] [ 2.304374 1.7243926 4.0177819 ] [ 2.6546732 3.9326851 1.0327493 ] [ 2.4395037 5.2336519 2.9949605 ] [ 5.5789552 3.3784185 3.28017 ] [ 4.9855019 3.5335771 0.993226 ] [ 3.5349725 3.7026322 4.4249954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7109724e-10 1.8794556e-10 1.7308178e-10 ] [ 2.304374e-10 1.7243926e-10 4.0177819e-10 ] [ 2.6546732e-10 3.9326851e-10 1.0327493e-10 ] [ 2.4395037e-10 5.2336519e-10 2.9949605e-10 ] [ 5.5789552e-10 3.3784185e-10 3.28017e-10 ] [ 4.9855019e-10 3.5335771e-10 9.932260000000001e-11 ] [ 3.5349725e-10 3.7026322e-10 4.4249954e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.07e-05 -1.2e-06 4.6e-06 ] [ 4.96e-05 1.9e-05 -2.34e-05 ] [ 1.24e-05 2.07e-05 2.86e-05 ] [ -1.32e-05 -1.7e-06 -1.66e-05 ] [ 4.5e-05 2.6e-06 -1.61e-05 ] [ -1.8e-06 -2.86e-05 9.5e-06 ] [ -6.12e-05 -1.08e-05 1.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.918682225856e-14 -1.92261194496e-15 7.370012455680001e-15 ] [ 7.946796039168e-14 3.04413557952e-14 -3.749093292672001e-14 ] [ 1.986699009792e-14 3.316505605055999e-14 4.582225135488e-14 ] [ -2.114873139456e-14 -2.72370025536e-15 -2.659613190528e-14 ] [ 7.209794793600001e-14 4.16565921408e-15 -2.579504359488e-14 ] [ -2.88391791744e-15 -4.582225135488e-14 1.52206778976e-14 ] [ -9.805320919295999e-14 -1.730350750464e-14 2.16293843808e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }