{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1140394 -1.435669 -6.8135562 ] [ 1.5564853 -1.4769586 1.7374061 ] [ -0.5646347 -4.2930806 7.1460099 ] [ 0.2076961 3.6437163 -1.4382304 ] [ 1.9144927 3.5619919 -0.6316294 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.989241122930059e-09 -2.300195307007316e-09 -1.091652044814689e-08 ] [ 2.493764358278874e-09 -2.366348538809499e-09 2.783631434255307e-09 ] [ -9.046445156324219e-10 -6.878273368530036e-09 1.144916999378535e-08 ] [ 3.327658356513389e-10 5.837877068687879e-09 -2.304299122203832e-09 ] [ 3.067355444632269e-09 5.706940145658972e-09 -1.011981857689932e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7183613992349507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.957471701539413e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9904374 2.1763088 1.1110852 ] [ 2.8882435 1.6040257 2.4026072 ] [ 0.8137428 1.951832 3.4596154 ] [ 0.6683437 4.0840905 2.4726396 ] [ 2.7428445 3.736284 1.4156317 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.904374e-11 2.1763088e-10 1.1110852e-10 ] [ 2.8882435e-10 1.6040257e-10 2.4026072e-10 ] [ 8.137428e-11 1.951832e-10 3.4596154e-10 ] [ 6.683437e-11 4.0840905e-10 2.4726396e-10 ] [ 2.7428445e-10 3.736284e-10 1.4156317e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.3e-06 -2.5e-06 -1.2e-06 ] [ -1.6e-06 -1.3e-06 1.6e-06 ] [ -7e-07 -1.3e-06 2.2e-06 ] [ 1.6e-06 -2.6e-06 -8e-07 ] [ 5e-06 7.6e-06 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.889359469440001e-15 -4.005441552e-15 -1.92261194496e-15 ] [ -2.56348259328e-15 -2.08282960704e-15 2.56348259328e-15 ] [ -1.12152363456e-15 -2.08282960704e-15 3.52478856576e-15 ] [ 2.56348259328e-15 -4.16565921408e-15 -1.28174129664e-15 ] [ 8.010883104e-15 1.217654231808e-14 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }