{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -46.9503354 -65.0320971 21.8752582 ] [ -95.2272675 100.2736033 -26.9361945 ] [ 17.2714485 -6.9931018 34.7439076 ] [ 43.1435339 -11.7831936 -60.6952682 ] [ 81.7626205 -16.4652108 31.012297 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.522273033634303e-08 -1.041929064336392e-07 3.504802755075689e-08 ] [ -1.525709029081676e-07 1.606560242142453e-07 -4.315654143677931e-08 ] [ 2.767191122203435e-08 -1.120418430314334e-08 5.566587693057502e-08 ] [ 6.912356192276689e-08 -1.887875745981834e-08 -9.724454050440323e-08 ] [ 1.309981600997094e-07 -2.638017601764445e-08 4.968717762006829e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 62.380918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.994524922707e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7740027 0.3212989 2.0559552 ] [ 1.7974252 3.5411529 1.5340328 ] [ 2.7820084 2.2841994 4.0173528 ] [ 3.5503518 1.6442569 0.1039098 ] [ 5.1847819 2.0126688 2.4490316 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7740027e-10 3.212989e-11 2.0559552e-10 ] [ 1.7974252e-10 3.5411529e-10 1.5340328e-10 ] [ 2.7820084e-10 2.2841994e-10 4.017352800000001e-10 ] [ 3.5503518e-10 1.6442569e-10 1.039098e-11 ] [ 5.184781900000001e-10 2.0126688e-10 2.4490316e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.02e-05 -3.26e-05 2.42e-05 ] [ -2.92e-05 2.65e-05 -1.19e-05 ] [ -5.9e-06 1.52e-05 -4.22e-05 ] [ -3.4e-06 3.94e-05 2.54e-05 ] [ 1.83e-05 -4.84e-05 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.236396800679999e-14 -5.22309582684e-14 3.877267454279999e-14 ] [ -4.67835577128e-14 4.2457680801e-14 -1.90659019446e-14 ] [ -9.452842140600001e-15 2.43530848368e-14 -6.761185395480001e-14 ] [ -5.4474005556e-15 6.31257593796e-14 4.06952865036e-14 ] [ 2.93198324022e-14 -7.754534908559998e-14 7.0495771896e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.94399396928671e-18 } }