{ "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" [ [ 0.7481215 0.3697243 2.264709 ] [ 0.2413431 2.204484 1.035234 ] [ 2.632044 0.6504598 2.339521 ] [ 2.588426 1.874203 0.0457334 ] [ 2.842468 2.848588 2.160611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481215e-11 3.697243e-11 2.264709e-10 ] [ 2.413431e-11 2.204484e-10 1.035234e-10 ] [ 2.632044e-10 6.504598e-11 2.339521e-10 ] [ 2.588426e-10 1.874203e-10 4.57334e-12 ] [ 2.842468e-10 2.848588e-10 2.160611e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.5297775 -3.2796 0.203495 ] [ 2.2485327 0.936683 -0.8769547 ] [ 14.4048716 1.4966081 -1.0486978 ] [ -1.4038555 -0.6137686 2.2530145 ] [ -0.7197714 1.4600775 -0.5308571 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.327926981592587e-08 -5.25449844557568e-09 3.260349314496961e-10 ] [ 3.6025465230443e-09 1.500731603700806e-09 -1.405036317840678e-09 ] [ 2.307914850314589e-08 2.397830508319908e-09 -1.680199097444394e-09 ] [ -2.249224461081495e-09 -9.833657015011469e-10 3.609727158223402e-09 ] [ -1.153200909400485e-09 2.339302035056112e-09 -8.505268346056877e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.886802 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.744257963967868e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.540506 0.3272931 2.3099782 ] [ 0.497971 2.339449 1.1002673 ] [ 2.8707444 0.5888325 2.1851983 ] [ 2.5861617 1.7158843 0.0766695 ] [ 2.5570195 2.9760003 2.173695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.405060000000001e-11 3.272931e-11 2.3099782e-10 ] [ 4.97971e-11 2.339449e-10 1.1002673e-10 ] [ 2.8707444e-10 5.888325e-11 2.1851983e-10 ] [ 2.5861617e-10 1.7158843e-10 7.66695e-12 ] [ 2.5570195e-10 2.9760003e-10 2.173695e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.65e-05 1.06e-05 -7.6e-06 ] [ -7.2e-06 1.1e-06 -0.0 ] [ -4.3e-06 -4.4e-06 2.2e-06 ] [ -3e-06 -4.7e-06 3.8e-06 ] [ -2e-06 -2.6e-06 1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.64359142432e-14 1.698307218048e-14 -1.217654231808e-14 ] [ -1.153567166976e-14 1.76239428288e-15 0.0 ] [ -6.889359469440001e-15 -7.04957713152e-15 3.52478856576e-15 ] [ -4.8065298624e-15 -7.53023011776e-15 6.08827115904e-15 ] [ -3.2043532416e-15 -4.16565921408e-15 2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }