{ "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" [ [ -4.4575546 -6.7231165 4.0355984 ] [ -3.6441703 9.340036 -0.927219 ] [ -0.0425204 -1.5145564 2.8282247 ] [ 2.9816218 -2.478286 -10.0492475 ] [ 5.1626234 1.3759229 4.1126434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.141789824899215e-09 -1.077162016395986e-08 6.465741460687784e-09 ] [ -5.83860450497677e-09 1.496438743991882e-08 -1.485568616400846e-09 ] [ -6.81251913483336e-11 -2.426586874955158e-09 4.531315530041659e-09 ] [ 4.777084779385021e-09 -3.970651921569324e-09 -1.610066953378291e-08 ] [ 8.271434581621635e-09 2.204471520565518e-09 6.589181159454314e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1666371 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.880041871977521e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7178794 0.6792855 1.9909959 ] [ 1.7323992 3.1745565 1.5760868 ] [ 2.9762115 2.2099469 3.5294427 ] [ 3.5466768 1.7242441 0.6283881 ] [ 5.1154031 2.015544 2.4353686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7178794e-10 6.792855e-11 1.9909959e-10 ] [ 1.7323992e-10 3.1745565e-10 1.5760868e-10 ] [ 2.9762115e-10 2.2099469e-10 3.5294427e-10 ] [ 3.5466768e-10 1.7242441e-10 6.283881e-11 ] [ 5.1154031e-10 2.015544e-10 2.4353686e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.21e-05 -5.9e-06 1.59e-05 ] [ -1.68e-05 4.5e-06 -1.43e-05 ] [ 1.34e-05 -2.29e-05 -4e-07 ] [ 3.37e-05 6.8e-06 2.5e-06 ] [ 2.17e-05 1.74e-05 -3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.347340263139999e-14 -9.452842140600001e-15 2.54746084806e-14 ] [ -2.691656745119999e-14 7.209794853e-15 -2.29111258662e-14 ] [ 2.14691668956e-14 -3.66898449186e-14 -6.408706536e-16 ] [ 5.399335256579999e-14 1.08948011112e-14 4.005441585e-15 ] [ 3.476723295779999e-14 2.78778734316e-14 -5.9280535458e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.674822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.710295038050915e-18 } }