{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.109941 1.98713 2.733868 ] [ 1.585411 0.9055996 0.7031416 ] [ 2.255239 0.4517476 2.903783 ] [ 2.131264 2.335298 0.7662027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.109941e-10 1.98713e-10 2.733868e-10 ] [ 1.585411e-10 9.055996e-11 7.031416000000001e-11 ] [ 2.255239e-10 4.517476000000001e-11 2.903783e-10 ] [ 2.131264e-10 2.335298e-10 7.662027e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5844745 6.3430748 5.4626565 ] [ -8.5460113 -25.1170668 -6.3223071 ] [ 4.1502181 -7.150547 4.4368235 ] [ 9.9802677 25.924539 -3.5771729 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.94731448335377e-09 1.016272614854564e-08 8.752140531761154e-09 ] [ -1.369221950595262e-08 -4.024197721003186e-08 -1.012945262513785e-08 ] [ 6.649382411040997e-09 -1.145643922933158e-08 7.108574882316029e-09 ] [ 1.599015157826539e-08 4.153569029081781e-08 -5.731262788939336e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.8272822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.52980544124399e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4856577 2.4304772 2.9865863 ] [ 2.0552579 0.4094088 0.5669099 ] [ 1.8237853 0.1974002 2.8104476 ] [ 1.7171542 2.642489 0.7430514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4856577e-10 2.4304772e-10 2.9865863e-10 ] [ 2.0552579e-10 4.094088e-11 5.669099e-11 ] [ 1.8237853e-10 1.974002e-11 2.8104476e-10 ] [ 1.7171542e-10 2.642489e-10 7.430514000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 -4.1e-06 -6e-06 ] [ 3.4e-06 3.5e-06 6.9e-06 ] [ -4.4e-06 -1.8e-06 -3e-07 ] [ -4.9e-06 2.3e-06 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 -6.568924145279999e-15 -9.6130597248e-15 ] [ 5.44740051072e-15 5.6076181728e-15 1.105501868352e-14 ] [ -7.04957713152e-15 -2.88391791744e-15 -4.8065298624e-16 ] [ -7.850665441919999e-15 3.68500622784e-15 -9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }