{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -25.9238161 30.3239649 -5.4497023 ] [ 36.8708993 -14.0204855 -9.0306524 ] [ -9.4854459 -8.3976174 1.7170724 ] [ -19.6576779 -39.8768889 0.8280582 ] [ 33.1001996 0.1476723 10.7265116 ] [ 11.3755988 25.6510434 7.762689 ] [ -26.2797579 6.1723112 -6.5539765 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.1534532419533e-08 4.858434801301614e-08 -8.731385687316057e-09 ] [ 5.907369333302695e-08 -2.246329426543581e-08 -1.446870026505602e-08 ] [ -1.51973597840511e-08 -1.345446637955183e-08 2.751053278166301e-09 ] [ -3.149507221007819e-08 -6.388981963219395e-08 1.326695499632099e-09 ] [ 5.303236637985615e-08 2.365971085490382e-10 1.718576624984995e-08 ] [ 1.822571859511844e-08 4.109750237319991e-08 1.243719893280882e-08 ] [ -4.21048140545569e-08 9.889132782416499e-09 -1.05006280080851e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.256522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.963711316250695e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5907864 4.0227008 3.165053 ] [ 5.8557978 2.2836953 1.0215928 ] [ 3.4551476 0.823728 0.9704624 ] [ 2.9940525 1.2739701 3.5882305 ] [ 5.354657 2.773032 3.8667935 ] [ 5.0770501 4.9521534 1.9342966 ] [ 3.0919136 3.5333408 0.3198582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5907864e-10 4.0227008e-10 3.165053e-10 ] [ 5.8557978e-10 2.2836953e-10 1.0215928e-10 ] [ 3.4551476e-10 8.237280000000001e-11 9.704624e-11 ] [ 2.9940525e-10 1.2739701e-10 3.5882305e-10 ] [ 5.354657e-10 2.773032000000001e-10 3.8667935e-10 ] [ 5.0770501e-10 4.9521534e-10 1.9342966e-10 ] [ 3.0919136e-10 3.5333408e-10 3.198582e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.23e-05 -2.28e-05 3e-07 ] [ -2.77e-05 -2.86e-05 -5.1e-06 ] [ 1.89e-05 2.13e-05 -3.92e-05 ] [ 2.17e-05 3.03e-05 4.72e-05 ] [ -6.6e-06 -2.36e-05 1.38e-05 ] [ -3.5e-06 1.99e-05 -1.34e-05 ] [ 1.94e-05 3.4e-06 -3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.572853893819999e-14 -3.65296272552e-14 4.806529901999999e-16 ] [ -4.438029276179999e-14 -4.58222517324e-14 -8.1711008334e-15 ] [ 3.02811383826e-14 3.41263623042e-14 -6.280532405279998e-14 ] [ 3.476723295779999e-14 4.854595201019999e-14 7.562273712480001e-14 ] [ -1.05743657844e-14 -3.78113685624e-14 2.21100375492e-14 ] [ -5.607618218999999e-15 3.18833150166e-14 -2.14691668956e-14 ] [ 3.10822266996e-14 5.4474005556e-15 -5.767835882399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.305738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.093120232572589e-18 } }