{ "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" [ [ 1.713643 2.381995 2.341744 ] [ 1.446412 4.331189 1.115178 ] [ 2.556484 4.191275 3.378185 ] [ 3.693858 2.577115 3.453442 ] [ 3.860603 3.859948 1.679861 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.713643e-10 2.381995e-10 2.341744e-10 ] [ 1.446412e-10 4.331189e-10 1.115178e-10 ] [ 2.556484e-10 4.191275e-10 3.378185e-10 ] [ 3.693858e-10 2.577115e-10 3.453442e-10 ] [ 3.860603e-10 3.859948e-10 1.679861e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.4651883 -14.1976896 -1.8729821 ] [ -9.7414022 7.8826591 -10.9863865 ] [ -4.7528254 13.8236227 13.5642687 ] [ 11.9426398 -12.2062538 10.9954723 ] [ 14.0167761 4.6976615 -11.7003724 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.83692566473297e-08 -2.27472063464953e-08 -3.000848131796888e-09 ] [ -1.560744685864969e-08 1.262941211975637e-08 -1.760213159737274e-08 ] [ -7.614865738624409e-09 2.214788510470017e-08 2.173235418938921e-08 ] [ 1.913421827819559e-08 -1.955657446591116e-08 1.7616688653714e-08 ] [ 2.24573509664082e-08 7.526483427732258e-09 -1.874606311393358e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 89.184788 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.428897822646044e-17 } "relaxed-configuration-positions" { "source-value" [ [ -1.4601041 -1.7675796 1.9731366 ] [ -1.8485916 7.1850015 -2.4653729 ] [ 1.5110742 7.5609975 6.9783927 ] [ 7.2136658 -0.6793535 6.8292128 ] [ 7.8549556 5.0424562 -1.3469592 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.4601041e-10 -1.7675796e-10 1.9731366e-10 ] [ -1.8485916e-10 7.185001500000001e-10 -2.4653729e-10 ] [ 1.5110742e-10 7.5609975e-10 6.9783927e-10 ] [ 7.2136658e-10 -6.793535e-11 6.8292128e-10 ] [ 7.854955600000001e-10 5.0424562e-10 -1.3469592e-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" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }