{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.1165463 -10.0650686 1.4944771 ] [ -6.709449 11.3765579 -8.1637397 ] [ -16.6149692 15.4572553 15.6910073 ] [ 6.9392783 -19.1433723 -11.9122747 ] [ 11.1890827 -13.8463804 14.0864459 ] [ 11.9815945 8.5125736 -14.2047729 ] [ 7.331009 7.7084346 3.0088569 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.261720044830074e-08 -1.612601759766819e-08 2.394416269940984e-09 ] [ -1.074972232624994e-08 1.822725509255754e-08 -1.307975288563681e-08 ] [ -2.662011520755208e-08 2.476525306339689e-08 2.513976505286213e-08 ] [ 1.111794945748477e-08 -3.067106354233032e-08 -1.908556802488733e-08 ] [ 1.792688671013774e-08 -2.218434695958335e-08 2.256897429114401e-08 ] [ 1.919663058780587e-08 1.363864640475929e-08 -2.275855504415341e-08 ] [ 1.174557122667439e-08 1.23502736990858e-08 4.820720180512764e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.1320165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.018043612259844e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4383793 1.5824776 2.8986583 ] [ 2.5267727 4.7157897 1.3568738 ] [ 1.7920696 3.8576903 3.4347333 ] [ 3.595411 1.2025741 2.0087335 ] [ 4.9684083 1.9355543 3.7895314 ] [ 3.7425513 2.9258066 0.3955248 ] [ 3.7526457 3.7255496 4.7508968 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4383793e-10 1.5824776e-10 2.8986583e-10 ] [ 2.5267727e-10 4.7157897e-10 1.3568738e-10 ] [ 1.7920696e-10 3.8576903e-10 3.4347333e-10 ] [ 3.595411e-10 1.2025741e-10 2.0087335e-10 ] [ 4.9684083e-10 1.9355543e-10 3.7895314e-10 ] [ 3.7425513e-10 2.9258066e-10 3.955248000000001e-11 ] [ 3.7526457e-10 3.7255496e-10 4.7508968e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.7e-06 -1.89e-05 -4e-07 ] [ -1.16e-05 3.8e-05 3.64e-05 ] [ -2.83e-05 1.58e-05 -2.51e-05 ] [ 2.33e-05 2.5e-05 0.0 ] [ -3.72e-05 7e-06 1.89e-05 ] [ 4e-07 -4.96e-05 -3.3e-05 ] [ 4.36e-05 -1.73e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.554111322176e-14 -3.028113813312e-14 -6.408706483200001e-16 ] [ -1.858524880128e-14 6.08827115904e-14 5.831922899712e-14 ] [ -4.534159836864e-14 2.531439060864e-14 -4.021463318208e-14 ] [ 3.733071526464e-14 4.005441552e-14 0.0 ] [ -5.960097029376001e-14 1.12152363456e-14 3.028113813312e-14 ] [ 6.408706483200001e-16 -7.946796039168e-14 -5.28718284864e-14 ] [ 6.985490066688e-14 -2.771765553984e-14 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }