{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8089267 0.144273 0.3085018 ] [ 0.0391703 1.366973 2.60492 ] [ 1.362051 2.292395 1.899207 ] [ 2.93764 0.2840218 0.2571454 ] [ 1.745173 0.2602682 2.163878 ] [ 2.951376 1.632187 2.170679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.089267000000001e-11 1.44273e-11 3.085018e-11 ] [ 3.91703e-12 1.366973e-10 2.60492e-10 ] [ 1.362051e-10 2.292395e-10 1.899207e-10 ] [ 2.93764e-10 2.840218e-11 2.571454e-11 ] [ 1.745173e-10 2.602682e-11 2.163878e-10 ] [ 2.951376e-10 1.632187e-10 2.170679e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9894376 -3.5834216 -10.1508474 ] [ -21.9896515 -5.0799402 10.2926194 ] [ -6.7005445 30.6756882 -9.372964 ] [ 9.1049782 -2.3559872 -8.8394818 ] [ -2.1112195 -26.2437366 12.5930309 ] [ 30.685875 6.5873974 5.477643 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.440266675686046e-08 -5.741274309989728e-09 -1.626345038558847e-08 ] [ -3.523130553283966e-08 -8.138961423502077e-09 1.649059416947252e-08 ] [ -1.073545574453003e-08 4.914787046099043e-08 -1.501714378840005e-08 ] [ 1.458778320493367e-08 -3.774707610744054e-09 -1.41624110799471e-08 ] [ -3.382546524277065e-09 -4.204710122295328e-08 2.017625969299198e-08 ] [ 4.91641915137912e-08 1.055417410619871e-08 8.776151551688775e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.8906127 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.631272087727564e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4036523 0.2729261 0.3448699 ] [ -0.3691848 1.1253071 2.5443492 ] [ 1.4442339 2.4514177 1.3985466 ] [ 2.9055803 0.5974875 0.2296642 ] [ 1.8286323 -0.1113046 2.5267649 ] [ 3.631423 1.6442843 2.3601364 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.036523e-11 2.729261e-11 3.448699e-11 ] [ -3.691848e-11 1.1253071e-10 2.5443492e-10 ] [ 1.4442339e-10 2.4514177e-10 1.3985466e-10 ] [ 2.9055803e-10 5.974875e-11 2.296642e-11 ] [ 1.8286323e-10 -1.113046e-11 2.5267649e-10 ] [ 3.631423e-10 1.6442843e-10 2.3601364e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.19e-05 1.74e-05 2.34e-05 ] [ 4.87e-05 -1.3e-06 -2.66e-05 ] [ 5e-06 -5.07e-05 1.06e-05 ] [ -3.89e-05 1.39e-05 4.12e-05 ] [ -7.3e-06 3.4e-05 -2.42e-05 ] [ -3.94e-05 -1.33e-05 -2.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.110943420352001e-14 2.787787320192e-14 3.749093292672001e-14 ] [ 7.802600143296e-14 -2.08282960704e-15 -4.261789811328e-14 ] [ 8.010883104e-15 -8.123035467456e-14 1.698307218048e-14 ] [ -6.232467054911999e-14 2.227025502912e-14 6.600967677696001e-14 ] [ -1.169588933184e-14 5.44740051072e-14 -3.877267422336e-14 ] [ -6.312575885952001e-14 -2.130894905664e-14 -3.909310954752e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }