{ "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" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.3502201 -21.7293682 0.0376615 ] [ -5.3899213 7.6420075 -9.553769 ] [ 0.574795 5.2879399 15.9405348 ] [ -0.1427627 0.3389325 -0.5498998 ] [ 14.310871 8.0271039 -6.2074936 ] [ -1.0027618 0.4333844 0.3329661 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.337852742275424e-08 -3.481428571479498e-08 6.034037480425921e-11 ] [ -8.635605894811944e-09 1.224384575247826e-08 -1.53068253323238e-08 ] [ 9.209231107527359e-10 8.47221367997549e-09 2.55395521796088e-08 ] [ -2.287310602622842e-10 5.430297275292961e-10 -8.81036603342596e-10 ] [ 2.292854293948472e-08 1.28608382013125e-08 -9.945501119685628e-09 ] [ -1.606601512191326e-09 6.943583534994355e-10 5.334705009389548e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6841367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.551569741337126e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3283937 0.9593068 1.1247299 ] [ -0.001215 3.3821061 0.2907493 ] [ 0.2267002 2.9207947 2.7571831 ] [ 1.7892281 -0.1277101 2.6682648 ] [ 2.3148361 2.397586 0.411943 ] [ 2.5973062 2.1306338 2.8835682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.283937e-11 9.593068e-11 1.1247299e-10 ] [ -1.215e-13 3.3821061e-10 2.907493e-11 ] [ 2.267002e-11 2.9207947e-10 2.7571831e-10 ] [ 1.7892281e-10 -1.277101e-11 2.6682648e-10 ] [ 2.3148361e-10 2.397586e-10 4.11943e-11 ] [ 2.5973062e-10 2.1306338e-10 2.8835682e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.45e-05 2.78e-05 5.8e-06 ] [ 6.6e-06 -3.81e-05 1.71e-05 ] [ 1.23e-05 2.09e-05 -1.33e-05 ] [ 2.22e-05 -7.9e-06 -3.94e-05 ] [ 7.6e-06 -1.96e-05 1.72e-05 ] [ -2.42e-05 1.7e-05 1.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.92533272096e-14 4.454051005824e-14 9.292624400640001e-15 ] [ 1.057436569728e-14 -6.104292925248e-14 2.739722021568e-14 ] [ 1.970677243584e-14 3.348549137472e-14 -2.130894905664e-14 ] [ 3.556832098176e-14 -1.265719530432e-14 -6.312575885952001e-14 ] [ 1.217654231808e-14 -3.140266176767999e-14 2.755743787776e-14 ] [ -3.877267422336e-14 2.72370025536e-14 2.018742542208e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.045052 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.211571367712028e-18 } }