{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6977917 0.2559248 0.8783031 ] [ 0.349385 0.3940236 2.698898 ] [ 1.248694 1.36901 2.090768 ] [ 0.3246804 2.316928 0.2892628 ] [ 2.775341 0.8800459 0.0497676 ] [ 2.033969 2.77175 0.0650166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.977917e-11 2.559248e-11 8.783031e-11 ] [ 3.49385e-11 3.940236e-11 2.698898e-10 ] [ 1.248694e-10 1.36901e-10 2.090768e-10 ] [ 3.246804e-11 2.316928e-10 2.892628e-11 ] [ 2.775341e-10 8.800459e-11 4.976760000000001e-12 ] [ 2.033969e-10 2.77175e-10 6.50166e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2546886 -9.4432421 -11.6524473 ] [ -39.2235829 -39.4237656 41.1034048 ] [ 40.8470221 37.4840577 -20.4699533 ] [ -12.561075 7.5411497 -8.829454 ] [ 3.1144833 -2.1033686 -0.9653857 ] [ 7.5684639 5.945169 0.8138355 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.080561205042829e-10 -1.51297417171743e-08 -1.866927863916408e-08 ] [ -6.284310750639066e-08 -6.316383554821929e-08 6.58549142058385e-08 ] [ 6.544414383792091e-08 6.005608089965822e-08 -3.279648060612781e-08 ] [ -2.012506069711536e-08 1.208225374329293e-08 -1.414634477322904e-08 ] [ 4.989952329132032e-09 -3.369967995844827e-09 -1.546718398594643e-09 ] [ 1.212601591594879e-08 9.525210778504915e-09 1.303908211277079e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 10.511946 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.684199412031208e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4670139 -0.0144658 0.3430929 ] [ 0.6805621 0.2606985 2.6970823 ] [ 1.1194303 2.1887014 2.6814067 ] [ 0.1567691 2.3967586 0.1059856 ] [ 2.9776458 0.4147941 -0.1538237 ] [ 2.0284399 2.7411956 0.3982723 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.670139e-11 -1.44658e-12 3.430929e-11 ] [ 6.805620999999999e-11 2.606985e-11 2.6970823e-10 ] [ 1.1194303e-10 2.1887014e-10 2.6814067e-10 ] [ 1.567691e-11 2.3967586e-10 1.059856e-11 ] [ 2.9776458e-10 4.147941e-11 -1.538237e-11 ] [ 2.0284399e-10 2.7411956e-10 3.982723e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.94e-05 5.8e-05 3.4e-06 ] [ -9.4e-06 1.73e-05 -3.39e-05 ] [ -2.94e-05 -2.13e-05 2.86e-05 ] [ -1.65e-05 -5.37e-05 5.89e-05 ] [ -1e-06 -1.25e-05 1.2e-05 ] [ 3.69e-05 1.21e-05 -6.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.108222644352e-14 9.29262440064e-14 5.44740051072e-15 ] [ -1.506046023552e-14 2.771765553984e-14 -5.431378744512e-14 ] [ -4.710399265152e-14 -3.412636202304e-14 4.582225135488e-14 ] [ -2.64359142432e-14 -8.603688453696e-14 9.436820296512001e-14 ] [ -1.6021766208e-15 -2.002720776e-14 1.92261194496e-14 ] [ 5.912031730752001e-14 1.938633711168e-14 -1.105501868352e-13 ] ] } "relaxed-potential-energy" { "source-value" -14.531218 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.328157775134814e-18 } }