{ "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" [ [ -13.9306138 -14.3953245 -25.4205412 ] [ 23.0876387 -16.6648927 3.8665051 ] [ -12.1806653 -5.1588271 20.2160573 ] [ -12.7392021 20.6173345 8.1739606 ] [ 15.7628424 15.6017099 -6.8359819 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.231930374375385e-08 -2.306385236272945e-08 -4.072819679872317e-08 ] [ 3.69904749546173e-08 -2.670010147208058e-08 6.194824075423966e-09 ] [ -1.951557716944982e-08 -8.265352170369464e-09 3.238969437081317e-08 ] [ -2.041045177226627e-08 3.303261131911326e-08 1.309612857266034e-08 ] [ 2.525485757063496e-08 2.499669484628391e-08 -1.095245038039196e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2002498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.525188789479876e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9269898 2.1193458 1.0021273 ] [ 2.9849705 1.5363216 2.4267425 ] [ 0.7664041 1.9010039 3.5577627 ] [ 0.6033389 4.1802749 2.502976 ] [ 2.8219085 3.8155947 1.3719704 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.269898e-11 2.1193458e-10 1.0021273e-10 ] [ 2.9849705e-10 1.5363216e-10 2.4267425e-10 ] [ 7.664041000000001e-11 1.9010039e-10 3.5577627e-10 ] [ 6.033389000000001e-11 4.1802749e-10 2.502976e-10 ] [ 2.8219085e-10 3.8155947e-10 1.3719704e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.08e-05 -3.4e-06 -5.42e-05 ] [ -3.89e-05 4.35e-05 3.19e-05 ] [ 5.61e-05 6.07e-05 -5.23e-05 ] [ 2.55e-05 -3.76e-05 4.91e-05 ] [ -5.36e-05 -6.32e-05 2.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.730350750464e-14 -5.44740051072e-15 -8.683797284736e-14 ] [ -6.232467054911999e-14 6.969468300480001e-14 5.110943420352001e-14 ] [ 8.988210842688002e-14 9.725212088256e-14 -8.379383726784e-14 ] [ 4.08555038304e-14 -6.024184094208e-14 7.866687208128001e-14 ] [ -8.587666687488e-14 -1.0125756243456e-13 4.101572149248001e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.709606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.677174007597941e-18 } }