{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3281318 14.7533403 -27.1116055 ] [ 1.8503895 -15.147394 29.6720305 ] [ -0.5675835 -1.2347544 1.394274 ] [ 6.6624778 0.5919811 -11.0911154 ] [ 1.382848 1.036827 7.1364165 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.494531468570102e-08 2.363745690736646e-08 -4.34375804844527e-08 ] [ 2.964650796273802e-09 -2.42688005328462e-08 4.753983355876454e-08 ] [ -9.093690140518369e-10 -1.978294632109931e-09 2.233873205789299e-09 ] [ 1.067446616775902e-08 9.48458278375467e-10 -1.776992579247484e-08 ] [ 2.215566735720039e-09 1.661179979214202e-09 1.143379967259136e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8263976 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.73274139740523e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.8220301 3.1520998 0.6311769 ] [ 0.3651777 1.9871709 2.1697215 ] [ 1.9655963 0.6045061 1.065024 ] [ 3.7059527 1.9485355 0.192282 ] [ 2.6345486 2.7241642 2.1537674 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.220301e-11 3.1520998e-10 6.311769000000001e-11 ] [ 3.651777e-11 1.9871709e-10 2.1697215e-10 ] [ 1.9655963e-10 6.045061000000001e-11 1.065024e-10 ] [ 3.7059527e-10 1.9485355e-10 1.92282e-11 ] [ 2.6345486e-10 2.7241642e-10 2.1537674e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 4.2e-06 -2.6e-06 ] [ -1.7e-06 -5.8e-06 3.7e-06 ] [ 4.2e-06 2.3e-06 -0.0 ] [ -2.9e-06 -2.4e-06 6e-07 ] [ 4e-07 1.8e-06 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 6.72914180736e-15 -4.16565921408e-15 ] [ -2.72370025536e-15 -9.292624400640001e-15 5.928053496960001e-15 ] [ 6.72914180736e-15 3.68500622784e-15 0.0 ] [ -4.646312200320001e-15 -3.84522388992e-15 9.6130597248e-16 ] [ 6.408706483200001e-16 2.88391791744e-15 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.225848 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.119014445585444e-18 } }