{ "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" [ [ 0.8888047 2.050538 1.655197 ] [ 2.913325 1.361036 3.047712 ] [ 2.022581 2.448681 4.72594 ] [ 1.815806 3.470528 2.839754 ] [ 4.233041 2.418243 4.364549 ] [ 4.034854 4.068796 2.809397 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.888047000000001e-11 2.050538e-10 1.655197e-10 ] [ 2.913325e-10 1.361036e-10 3.047712e-10 ] [ 2.022581e-10 2.448681e-10 4.72594e-10 ] [ 1.815806e-10 3.470528e-10 2.839754e-10 ] [ 4.233041e-10 2.418243e-10 4.364549e-10 ] [ 4.034854000000001e-10 4.068796e-10 2.809397e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0798685 -1.9927823 -2.1873848 ] [ 1.2838796 -8.9783812 -7.1010625 ] [ -6.6999128 1.2167956 8.8634561 ] [ -2.6821745 7.1778791 -1.4265797 ] [ 7.8317162 1.3790907 3.1997256 ] [ 1.3463599 1.1973982 -1.3481547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.730140064238365e-09 -3.192789211404052e-09 -3.504576787253284e-09 ] [ 2.057001879042055e-09 -1.438495245127025e-08 -1.13771563203396e-08 ] [ -1.073444364955867e-08 1.949521462612309e-09 1.420082214290715e-08 ] [ -4.29731727680593e-09 1.150023008094895e-08 -2.285632643047878e-09 ] [ 1.254779259638062e-08 2.209546877502706e-09 5.126525549295252e-09 ] [ 2.157106354962626e-09 1.918443401828003e-09 -2.159981941561638e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.335611 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.136600416828331e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3725628 1.9631877 1.272019 ] [ 2.4301967 1.0312622 3.1819251 ] [ 2.065865 2.5710485 5.1772187 ] [ 1.7020487 3.61369 2.9388161 ] [ 4.3953718 2.3336074 4.0295583 ] [ 3.9423667 4.3050261 2.8430117 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3725628e-10 1.9631877e-10 1.272019e-10 ] [ 2.4301967e-10 1.0312622e-10 3.1819251e-10 ] [ 2.065865e-10 2.5710485e-10 5.1772187e-10 ] [ 1.7020487e-10 3.61369e-10 2.9388161e-10 ] [ 4.395371800000001e-10 2.3336074e-10 4.0295583e-10 ] [ 3.9423667e-10 4.3050261e-10 2.8430117e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.94e-05 -4.73e-05 -4.82e-05 ] [ -6.12e-05 -0.000135 3.53e-05 ] [ 4.01e-05 -1.04e-05 5.56e-05 ] [ -3.82e-05 0.0001821 -6.07e-05 ] [ 6.61e-05 -6.6e-06 -3.6e-05 ] [ -4.63e-05 1.73e-05 5.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.312575885952001e-14 -7.578295416384e-14 -7.722491312256001e-14 ] [ -9.805320919295999e-14 -2.16293843808e-13 5.655683471424e-14 ] [ 6.424728249408e-14 -1.666263685632e-14 8.908102011648e-14 ] [ -6.120314691456e-14 2.9175636264768e-13 -9.725212088256e-14 ] [ 1.0590387463488e-13 -1.057436569728e-14 -5.76783583488e-14 ] [ -7.418077754303999e-14 2.771765553984e-14 8.65175375232e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.180676 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.073083065833966e-18 } }