{ "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" [ [ 0.1226517 0.1643142 2.08525 ] [ 0.897513 2.739377 0.422181 ] [ 0.4967103 2.508008 2.34433 ] [ 2.384655 1.344784 0.6822557 ] [ 2.452846 2.947826 1.504929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.226517e-11 1.643142e-11 2.08525e-10 ] [ 8.97513e-11 2.739377e-10 4.22181e-11 ] [ 4.967103e-11 2.508008e-10 2.34433e-10 ] [ 2.384655e-10 1.344784e-10 6.822557000000001e-11 ] [ 2.452846e-10 2.947826e-10 1.504929e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0937647 -2.1901081 0.5583219 ] [ -2.4499915 1.6407774 -3.5732667 ] [ -2.1370727 1.0009775 3.084186 ] [ 2.2909691 -3.3616469 -1.6992546 ] [ 3.3898597 2.9100001 1.6300135 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.752404230996326e-09 -3.508939994844708e-09 8.945302950606355e-10 ] [ -3.925319102458723e-09 2.628815190217009e-09 -5.725004366623168e-09 ] [ -3.423967916889932e-09 1.603742748446832e-09 4.941410703398669e-09 ] [ 3.670537130995217e-09 -5.385952070564796e-09 -2.722505992906856e-09 ] [ 5.431153959132101e-09 4.662334126745662e-09 2.611569521288381e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.949122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.914460390748694e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.7919835 -1.603734 2.335009 ] [ -0.1746237 3.4916572 -1.3013239 ] [ -0.7456607 3.5636718 4.2180307 ] [ 3.7960838 -0.2895204 -0.3985747 ] [ 4.2705601 4.5422345 2.1858045 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.919835e-11 -1.603734e-10 2.335009e-10 ] [ -1.746237e-11 3.4916572e-10 -1.3013239e-10 ] [ -7.456607e-11 3.5636718e-10 4.2180307e-10 ] [ 3.7960838e-10 -2.895204e-11 -3.985747000000001e-11 ] [ 4.2705601e-10 4.5422345e-10 2.1858045e-10 ] ] } "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" 2.220446e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.557546668948877e-34 } }