{ "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" [ [ 0.1032294 0.9160098 0.6340424 ] [ 0.5975465 2.782152 1.021804 ] [ 1.919093 1.0464 1.488365 ] [ 2.284896 2.976774 2.795304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032294e-11 9.160098e-11 6.340424e-11 ] [ 5.975465e-11 2.782152e-10 1.021804e-10 ] [ 1.919093e-10 1.0464e-10 1.488365e-10 ] [ 2.284896e-10 2.976774e-10 2.795304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9368616 -9.0628814 -4.8470577 ] [ 1.5712034 10.3977685 1.8931035 ] [ 8.0584634 -0.8955897 3.7831566 ] [ -0.6928052 -0.4392974 -0.8292024 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.431843071884528e-08 -1.452033669616317e-08 -7.76584252660862e-09 ] [ 2.51734535400147e-09 1.665906159919069e-08 3.033086168454653e-09 ] [ 1.291108165905248e-08 -1.434892879169286e-09 6.061285057345217e-09 ] [ -1.109996294208668e-09 -7.038320238582259e-10 -1.32852869919125e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.77323051938796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.841028481452431e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0614028 0.8516995 0.9021456 ] [ 0.8399131 2.9506815 0.8678082 ] [ 2.1692207 1.1223127 1.3148987 ] [ 1.9570339 2.796642 2.8546629 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.14028e-12 8.516995000000001e-11 9.021456e-11 ] [ 8.399131e-11 2.9506815e-10 8.678082e-11 ] [ 2.1692207e-10 1.1223127e-10 1.3148987e-10 ] [ 1.9570339e-10 2.796642e-10 2.8546629e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 -4.4e-06 6e-07 ] [ 4.7e-06 3.3e-06 3.1e-06 ] [ -2.1e-06 -1.3e-06 -2.8e-06 ] [ -2.2e-06 2.4e-06 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 -7.04957713152e-15 9.6130597248e-16 ] [ 7.53023011776e-15 5.28718284864e-15 4.96674752448e-15 ] [ -3.36457090368e-15 -2.08282960704e-15 -4.48609453824e-15 ] [ -3.52478856576e-15 3.84522388992e-15 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -3.8437085193879597 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.158299926933172e-19 } }