{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3142934 0.7540522 2.32218 ] [ 0.538251 2.820956 1.392978 ] [ 2.532298 0.1763292 2.432177 ] [ 1.796653 2.418536 0.8624239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.142934e-11 7.540522e-11 2.32218e-10 ] [ 5.38251e-11 2.820956e-10 1.392978e-10 ] [ 2.532298e-10 1.763292e-11 2.432177e-10 ] [ 1.796653e-10 2.418536e-10 8.624239e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7550952 0.7440842 0.7235488 ] [ -158.6186015 48.852743 67.5661069 ] [ 3.342252 -1.1298234 0.3362565 ] [ 160.0314447 -48.4670039 -68.6259122 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.618502359118301e-09 1.192154309146671e-09 1.159252971367895e-09 ] [ -2.541350149472918e-07 7.827072269655084e-08 1.082528368336536e-07 ] [ 5.354878015222041e-09 -1.810176637112767e-09 5.387423028920352e-10 ] [ 2.563986392911881e-07 -7.765270052880242e-08 -1.099508321079135e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 37.353547 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.984697970735398e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.04254 0.6542635 2.7142938 ] [ 0.0911197 2.8465558 1.3881082 ] [ 2.4996232 0.238372 2.1167571 ] [ 2.5482125 2.4306821 0.7905998 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.254e-12 6.542635e-11 2.7142938e-10 ] [ 9.11197e-12 2.8465558e-10 1.3881082e-10 ] [ 2.4996232e-10 2.38372e-11 2.1167571e-10 ] [ 2.5482125e-10 2.4306821e-10 7.905998e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 -2.1e-06 -2.5e-06 ] [ -8.2e-06 1.02e-05 1.2e-06 ] [ 9e-06 -3.6e-06 3.5e-06 ] [ 1.1e-06 -4.5e-06 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 -3.36457090368e-15 -4.005441552e-15 ] [ -1.313784829056e-14 1.634220153216e-14 1.92261194496e-15 ] [ 1.44195895872e-14 -5.76783583488e-15 5.6076181728e-15 ] [ 1.76239428288e-15 -7.2097947936e-15 -3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.704511 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.715051726129643e-18 } }