{ "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" [ [ -6.347293 -1.9060977 -5.6800919 ] [ 0.673965 0.0735927 0.135113 ] [ -6.1971044 3.2440332 2.6756106 ] [ 8.1806403 -10.7880489 -6.4161444 ] [ -3.4879442 -6.4819007 7.7495862 ] [ -0.6144966 9.2851446 -5.4279038 ] [ 7.7922329 6.5732768 6.9638304 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.016948444996749e-08 -3.053905171900652e-09 -9.100510446175451e-09 ] [ 1.079810966237472e-09 1.179085034015482e-10 2.164748897661504e-10 ] [ -9.92885578633681e-09 5.19751415013901e-09 4.286800749684661e-09 ] [ 1.31068306318343e-08 -1.728435973162716e-08 -1.027979655335684e-08 ] [ -5.58830265189496e-09 -1.038514975988715e-08 1.241620583051431e-08 ] [ -9.84532086081089e-10 1.487644159886737e-08 -8.69646056831148e-09 ] [ 1.248453337620858e-08 1.053155041100704e-08 1.115728625809631e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.8876132 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.263734946295348e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.157838 3.1031847 0.9127763 ] [ 1.009627 2.8604377 1.9467038 ] [ 1.8554098 4.0942708 3.81888 ] [ 4.5497936 1.8387222 2.3986439 ] [ 3.5405215 2.6067103 4.6506069 ] [ 3.5309172 5.0656125 2.3246273 ] [ 5.3724142 4.0567148 3.4940358 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.157838e-10 3.1031847e-10 9.127763e-11 ] [ 1.009627e-10 2.8604377e-10 1.9467038e-10 ] [ 1.8554098e-10 4.0942708e-10 3.81888e-10 ] [ 4.5497936e-10 1.8387222e-10 2.3986439e-10 ] [ 3.5405215e-10 2.6067103e-10 4.6506069e-10 ] [ 3.5309172e-10 5.0656125e-10 2.3246273e-10 ] [ 5.3724142e-10 4.0567148e-10 3.4940358e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-06 1.61e-05 2.55e-05 ] [ 2.91e-05 1.74e-05 -2.5e-06 ] [ -2e-06 -1.06e-05 -1.32e-05 ] [ -6.3e-06 1.53e-05 1.08e-05 ] [ 2e-07 1.97e-05 -1.63e-05 ] [ -2.47e-05 -4.48e-05 8.6e-06 ] [ 9.7e-06 -1.31e-05 -1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-15 2.579504359488e-14 4.08555038304e-14 ] [ 4.662333966527999e-14 2.787787320192e-14 -4.005441552e-15 ] [ -3.2043532416e-15 -1.698307218048e-14 -2.114873139456e-14 ] [ -1.009371271104e-14 2.451330229824e-14 1.730350750464e-14 ] [ 3.2043532416e-16 3.156287942976e-14 -2.611547891904e-14 ] [ -3.957376253376001e-14 -7.177751261183999e-14 1.377871893888e-14 ] [ 1.554111322176e-14 -2.098851373248e-14 -2.066807840832e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }