{ "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" [ [ 0.1779892 2.357943 0.2667025 ] [ 0.683577 1.802827 2.30843 ] [ 1.994264 0.9284256 0.4445094 ] [ 2.959137 1.015728 2.327469 ] [ 2.670153 2.85418 1.122954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.779892e-11 2.357943e-10 2.667025e-11 ] [ 6.83577e-11 1.802827e-10 2.30843e-10 ] [ 1.994264e-10 9.284256e-11 4.445094e-11 ] [ 2.959137e-10 1.015728e-10 2.327469e-10 ] [ 2.670153e-10 2.85418e-10 1.122954e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3761994 1.4539646 -2.8359463 ] [ -5.4320261 0.1848963 6.4980721 ] [ 0.2591455 -6.5219975 -7.9121126 ] [ 4.0100223 -3.1220765 5.533929 ] [ 4.5390576 8.0052131 -1.2839422 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.409267745838988e-09 2.329508089590824e-09 -4.543686859704262e-09 ] [ -8.703065220995404e-09 2.96236529132423e-10 1.041105919889276e-08 ] [ 4.151968614855263e-10 -1.044939191541605e-08 -1.26766018288571e-08 ] [ 6.424763977946644e-09 -5.002117976649091e-09 8.866331664967122e-09 ] [ 7.272371967184558e-09 1.282576527334189e-08 -2.057102175298518e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6094571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.385164400200568e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5994981 2.4082168 0.3755369 ] [ 0.530262 1.675388 2.6100846 ] [ 1.8889909 0.4516846 0.1652443 ] [ 2.7945458 1.175418 2.2124888 ] [ 2.6718234 3.2483963 1.1067103 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.994981e-11 2.4082168e-10 3.755369e-11 ] [ 5.30262e-11 1.675388e-10 2.6100846e-10 ] [ 1.8889909e-10 4.516846e-11 1.652443e-11 ] [ 2.7945458e-10 1.175418e-10 2.2124888e-10 ] [ 2.6718234e-10 3.2483963e-10 1.1067103e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 5.4e-06 1.8e-06 ] [ -5.7e-06 -6.9e-06 2e-07 ] [ -5.9e-06 -8.5e-06 -2.7e-06 ] [ 4.7e-06 6.1e-06 2.6e-06 ] [ 1.5e-06 4e-06 -1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.491536090240001e-15 8.65175375232e-15 2.88391791744e-15 ] [ -9.13240673856e-15 -1.105501868352e-14 3.2043532416e-16 ] [ -9.45284206272e-15 -1.36185012768e-14 -4.32587687616e-15 ] [ 7.53023011776e-15 9.77327738688e-15 4.16565921408e-15 ] [ 2.4032649312e-15 6.4087064832e-15 -3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }