{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3037519 -4.5394113 -2.1926238 ] [ -0.7900692 -5.9597751 8.5366871 ] [ -3.8826948 7.446049 -7.4354522 ] [ 1.4816729 1.1344216 2.961595 ] [ 1.4565144 -0.860845 -3.0027364 ] [ -0.2523188 -1.0301142 0.7522277 ] [ 2.2906473 3.809675 0.3803026 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.866641967131046e-10 -7.272938716975564e-09 -3.512970619512289e-09 ] [ -1.265830411483073e-09 -9.548612409115011e-09 1.367728060338922e-08 ] [ -6.220762885513303e-09 1.192988572341906e-08 -1.191290777806389e-08 ] [ 2.373901699611019e-09 1.817543780624894e-09 4.744998308371229e-09 ] [ 2.33359333876453e-09 -1.37922574449573e-09 -4.810914098141276e-09 ] [ -4.042592856789192e-10 -1.650424901591603e-09 1.205201644387562e-09 ] [ 3.670021580795187e-09 6.103772268133949e-09 6.093119395694484e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.985081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.080439336879735e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7611629 2.062291 1.9687922 ] [ 2.5009333 1.9696428 4.4968849 ] [ 1.8062377 4.0567462 3.2205828 ] [ 5.0744892 2.7241774 1.9863622 ] [ 4.6659001 3.0778494 4.3827548 ] [ 5.2159192 5.0780665 1.6154448 ] [ 3.8631136 5.2542487 3.5743344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7611629e-10 2.062291e-10 1.9687922e-10 ] [ 2.5009333e-10 1.9696428e-10 4.496884900000001e-10 ] [ 1.8062377e-10 4.0567462e-10 3.2205828e-10 ] [ 5.074489200000001e-10 2.7241774e-10 1.9863622e-10 ] [ 4.6659001e-10 3.0778494e-10 4.3827548e-10 ] [ 5.2159192e-10 5.0780665e-10 1.6154448e-10 ] [ 3.8631136e-10 5.2542487e-10 3.5743344e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.2e-06 8.1e-06 1.22e-05 ] [ 2.1e-06 7e-07 -6.5e-06 ] [ 2.5e-06 -3.6e-06 8.2e-06 ] [ 1.97e-05 -5.8e-06 -2.7e-06 ] [ -9.3e-06 -1.5e-06 -1.01e-05 ] [ 6.2e-06 -2.6e-06 -2.8e-06 ] [ -1.29e-05 4.8e-06 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.31378483988e-14 1.29776307354e-14 1.95465549348e-14 ] [ 3.364570931399999e-15 1.1215236438e-15 -1.0414148121e-14 ] [ 4.005441585e-15 -5.767835882399999e-15 1.31378483988e-14 ] [ 3.15628796898e-14 -9.2926244772e-15 -4.3258769118e-15 ] [ -1.49002426962e-14 -2.403264951e-15 -1.61819840034e-14 ] [ 9.9334951308e-15 -4.165659248399999e-15 -4.486094575199999e-15 ] [ -2.06680785786e-14 7.690447843199998e-15 2.8839179412e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.082717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.897170665663458e-18 } }