{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.2004703e-10 2.2575378e-10 1.7708931e-10 ] [ 2.1041902e-10 2.7400721e-10 4.2059828e-10 ] [ 2.1045258e-10 4.5360568e-10 2.4844128e-10 ] [ 4.478929e-10 2.381853e-10 1.8281048e-10 ] [ 4.3295512e-10 1.659051e-10 3.9879211e-10 ] [ 4.3870086e-10 4.5747515e-10 2.5094995e-10 ] [ 4.228694e-10 3.9386417e-10 4.6963339e-10 ] ] "source-value" [ [ 2.2004703 2.2575378 1.7708931 ] [ 2.1041902 2.7400721 4.2059828 ] [ 2.1045258 4.5360568 2.4844128 ] [ 4.478929 2.381853 1.8281048 ] [ 4.3295512 1.659051 3.9879211 ] [ 4.3870086 4.5747515 2.5094995 ] [ 4.228694 3.9386417 4.6963339 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.30889672823488e-12 2.63253640563648e-12 4.674350291183999e-12 ] [ -6.08698941774336e-12 3.56019666907968e-12 2.13121534098816e-12 ] [ 4.590236018592001e-13 -6.720009400621439e-12 -1.01449823629056e-12 ] [ 2.20795960112448e-12 2.62532661084288e-12 -2.31402369342144e-12 ] [ -5.780653247846399e-13 -1.41247890889728e-12 -1.40094323722752e-12 ] [ 9.089147969798399e-13 1.6486397428032e-12 -7.7769653173632e-13 ] [ 7.802600143296001e-13 -2.33389068351936e-12 -1.29840393349632e-12 ] ] "source-value" [ [ 0.0014411 0.0016431 0.0029175 ] [ -0.0037992 0.0022221 0.0013302 ] [ 0.0002865 -0.0041943 -0.0006332 ] [ 0.0013781 0.0016386 -0.0014443 ] [ -0.0003608 -0.0008816 -0.0008744 ] [ 0.0005673 0.001029 -0.0004854 ] [ 0.000487 -0.0014567 -0.0008104 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.314441541084145e-18 "source-value" -14.445608 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.793379316576693e-09 -4.661974918747279e-09 -8.208163917848967e-09 ] [ -8.236724638726672e-09 -4.881633974329607e-09 6.14442825068735e-09 ] [ -7.61972562096828e-09 1.348987565376426e-08 -4.886205304664074e-09 ] [ 4.851742325333003e-09 -3.282725313183053e-10 -2.206048204415866e-09 ] [ 8.358187570961464e-09 -1.099885101750695e-08 4.678474614241264e-09 ] [ 3.24862795055685e-09 2.779165527142489e-09 -1.017132374872817e-09 ] [ 6.191271889637991e-09 4.601691260995396e-09 5.494646776655447e-09 ] ] "source-value" [ [ -4.2400939 -2.9097759 -5.123133 ] [ -5.1409592 -3.0468763 3.8350505 ] [ -4.7558587 8.4197182 -3.0497295 ] [ 3.0282194 -0.2048916 -1.376907 ] [ 5.2167704 -6.8649429 2.9200742 ] [ 2.0276341 1.7346187 -0.6348441 ] [ 3.864288 2.8721498 3.4294888 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.501519025444631e-18 "source-value" -9.3717447 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] "source-value" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] } "instance-id" 1 }