{ "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" [ [ 1.407318 2.912531 0.4915679 ] [ 2.588763 3.80351 2.492541 ] [ 3.156708 1.860824 1.786936 ] [ 3.58937 3.640178 0.244631 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.407318e-10 2.912531e-10 4.915679e-11 ] [ 2.588763e-10 3.80351e-10 2.492541e-10 ] [ 3.156708e-10 1.860824e-10 1.786936e-10 ] [ 3.58937e-10 3.640178e-10 2.44631e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6835806 -0.2506747 -0.2018618 ] [ -1.1161644 3.7390414 1.6202852 ] [ 1.3118738 -4.3978553 -0.6456078 ] [ 1.4878712 0.9094886 -0.7728156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.697393476552437e-09 -4.016251437660538e-10 -3.234182565926055e-10 ] [ -1.78829250664926e-09 5.990604715283301e-09 2.595983066468252e-09 ] [ 2.101853531800055e-09 -7.04614094332137e-09 -1.034377723366122e-09 ] [ 2.383832451401641e-09 1.457161371804123e-09 -1.238187086509525e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.185697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.47171089791527e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.552414 2.3031365 -0.1913163 ] [ 3.4294724 3.9966694 2.8335698 ] [ 2.6372699 1.9693763 1.8912609 ] [ 3.1230027 3.9478608 0.4821616 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.552414e-10 2.3031365e-10 -1.913163e-11 ] [ 3.4294724e-10 3.9966694e-10 2.8335698e-10 ] [ 2.6372699e-10 1.9693763e-10 1.8912609e-10 ] [ 3.1230027e-10 3.9478608e-10 4.821616e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.94e-05 -9.1e-06 -2e-06 ] [ 1.68e-05 -3.54e-05 0.0 ] [ -1.77e-05 3.28e-05 1.72e-05 ] [ -2.85e-05 1.17e-05 -1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.710399265152e-14 -1.457980724928e-14 -3.2043532416e-15 ] [ 2.691656722944e-14 -5.671705237632e-14 0.0 ] [ -2.835852618816e-14 5.255139316223999e-14 2.755743787776e-14 ] [ -4.56620336928e-14 1.874546646336e-14 -2.435308463616e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.278678 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.64682575843313e-18 } }