{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.61188 5.080623 2.93239 ] [ 4.855786 1.762639 3.084137 ] [ 3.780411 3.32193 1.747479 ] [ 4.346291 4.090656 3.759617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61188e-10 5.080623e-10 2.93239e-10 ] [ 4.855786000000001e-10 1.762639e-10 3.084137e-10 ] [ 3.780411e-10 3.32193e-10 1.747479e-10 ] [ 4.346291e-10 4.090656e-10 3.759617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6357484 0.815975 -0.7437916 ] [ 0.034733 0.0729329 0.393078 ] [ -0.6097174 -0.259042 -1.8841411 ] [ 2.2107328 -0.6298659 2.2348547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.620757843991007e-09 1.30733606815728e-09 -1.191685512267425e-09 ] [ 5.56484005702464e-11 1.168513872671443e-10 6.297803817508223e-10 ] [ -9.768749635749618e-10 -4.150310362052736e-10 -3.018726820708395e-09 ] [ 3.541984406995722e-09 -1.009156419219151e-09 3.580631951224998e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.533141 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.847812887458993e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5036169 4.7558671 2.9806312 ] [ 4.5233479 1.8653732 3.1987181 ] [ 3.9057542 3.4686944 1.5519028 ] [ 4.6616489 4.1659134 3.7923709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5036169e-10 4.7558671e-10 2.9806312e-10 ] [ 4.5233479e-10 1.8653732e-10 3.1987181e-10 ] [ 3.9057542e-10 3.4686944e-10 1.5519028e-10 ] [ 4.6616489e-10 4.1659134e-10 3.7923709e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.39e-05 6.25e-05 -7.1e-06 ] [ 4.78e-05 -0.0001098 -1.5e-06 ] [ -1.54e-05 -7e-07 -2.4e-05 ] [ 1.5e-06 4.8e-05 3.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.431378744512e-14 1.001360388e-13 -1.137545400768e-14 ] [ 7.658404247424001e-14 -1.7591899296384e-13 -2.4032649312e-15 ] [ -2.467351996032e-14 -1.12152363456e-15 -3.84522388992e-14 ] [ 2.4032649312e-15 7.69044777984e-14 5.223095783807999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.031003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927579173137467e-18 } }