{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9889648 -7.5270914 -15.5637443 ] [ 13.6196076 -12.1668381 3.1757676 ] [ -7.1262064 -7.7451966 15.7631516 ] [ -9.530957 15.2304407 2.8345275 ] [ 12.0265206 12.2086854 -6.2097024 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.440190924775415e-08 -1.205972986370474e-08 -2.493586724956926e-08 ] [ 2.182101688119e-08 -1.949342355287869e-08 5.088140601814126e-09 ] [ -1.141744128907533e-08 -1.240917291601965e-08 2.525535296364612e-08 ] [ -1.527027647925011e-08 2.440185601402079e-08 4.541413691514672e-09 ] [ 1.926861013488959e-08 1.95604703185823e-08 -9.94904000740565e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 88.976754 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.425564750534729e-17 } "relaxed-configuration-positions" { "source-value" [ [ -1.1894015 0.2896756 -2.5891165 ] [ 7.0350997 -2.2619055 2.9308773 ] [ -1.4368195 -0.1830753 7.8201559 ] [ -2.722241 8.6094942 3.2333913 ] [ 6.416974 7.098352 -0.533729 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.1894015e-10 2.896756e-11 -2.5891165e-10 ] [ 7.035099700000001e-10 -2.2619055e-10 2.9308773e-10 ] [ -1.4368195e-10 -1.830753e-11 7.8201559e-10 ] [ -2.722241e-10 8.609494200000001e-10 3.2333913e-10 ] [ 6.416974e-10 7.098352e-10 -5.337290000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }