{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8655469 -0.1638044 -0.0777611 ] [ -0.4446553 0.370843 4.5057887 ] [ -1.4250805 0.9028387 -2.1353901 ] [ -0.5561482 -3.4412784 -1.9127923 ] [ 1.0268286 -0.6217199 -1.8320885 ] [ -1.4085947 2.0721272 0.7399334 ] [ 3.673197 0.8809937 0.7123099 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.386759007385916e-09 -2.624435800641715e-10 -1.245870164276909e-10 ] [ -7.124163259748103e-10 5.941559845873343e-10 7.219069313404826e-09 ] [ -2.283230659857975e-09 1.446507057493465e-09 -3.421272094507774e-09 ] [ -8.910476437400025e-10 -5.513535798144031e-09 -3.06463110350626e-09 ] [ 1.645160776488795e-09 -9.96105088466114e-10 -2.935329361936541e-09 ] [ -2.25681749652279e-09 3.319913755163766e-09 1.185503994429055e-09 ] [ 5.885110356992698e-09 1.411507509212089e-09 1.141246268544386e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.781814 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169395990781413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8251134 2.4402537 1.7026543 ] [ 2.4986523 2.5840678 4.939966 ] [ 1.2713434 3.9708595 3.4417908 ] [ 3.4701695 1.4046913 3.0983122 ] [ 4.0662953 3.2767426 1.640538 ] [ 3.3051157 5.1167445 2.9677489 ] [ 4.5641425 3.3830466 4.0334067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8251134e-10 2.4402537e-10 1.7026543e-10 ] [ 2.4986523e-10 2.5840678e-10 4.939966e-10 ] [ 1.2713434e-10 3.9708595e-10 3.4417908e-10 ] [ 3.4701695e-10 1.4046913e-10 3.0983122e-10 ] [ 4.0662953e-10 3.2767426e-10 1.640538e-10 ] [ 3.3051157e-10 5.1167445e-10 2.9677489e-10 ] [ 4.5641425e-10 3.3830466e-10 4.0334067e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.6e-06 -7e-07 4.7e-06 ] [ -4.3e-06 -5.8e-06 -6e-07 ] [ -1.62e-05 5.9e-06 -2.1e-06 ] [ 2e-05 4e-07 3.3e-06 ] [ -1.03e-05 8e-06 -1.75e-05 ] [ 2e-05 -5.6e-06 -6.1e-06 ] [ -1.6e-06 -2.1e-06 1.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.217654231808e-14 -1.12152363456e-15 7.53023011776e-15 ] [ -6.889359469440001e-15 -9.292624400640001e-15 -9.6130597248e-16 ] [ -2.595526125696e-14 9.45284206272e-15 -3.36457090368e-15 ] [ 3.2043532416e-14 6.408706483200001e-16 5.28718284864e-15 ] [ -1.650241919424e-14 1.28174129664e-14 -2.8038090864e-14 ] [ 3.2043532416e-14 -8.972189076479999e-15 -9.77327738688e-15 ] [ -2.56348259328e-15 -3.36457090368e-15 2.931983216064e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319314854257e-18 } }