{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 8.0764698 -0.6957901 7.0312876 ] [ -989.2852768 -325.289689 713.2269522 ] [ -17.9916866 -5.1393343 0.0470263 ] [ 24.7837182 101.1018558 -169.8127352 ] [ 962.3036953 195.1790281 -559.1858612 ] [ 12.1130802 34.8439294 8.6933303 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.293993109215725e-08 -1.114778631204094e-09 1.126536460684094e-08 ] [ -1.585009741790617e-06 -5.211715347031029e-07 1.142715548139279e-06 ] [ -2.882585963928064e-08 -8.234121261935532e-09 7.534443842272704e-11 ] [ 3.970789387653546e-08 1.619830296822529e-07 -2.720699942515412e-07 ] [ 1.541780482719107e-06 3.127112756922863e-07 -8.959145134965538e-07 ] [ 1.940729390231539e-08 5.582612906148578e-08 1.392825056355225e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 141.95029 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.2742943595378e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.7639568 1.1919004 0.8696788 ] [ 1.1162123 0.41719 2.9156252 ] [ 0.1107468 2.3728572 2.6179313 ] [ 2.6653588 1.9521843 0.0424139 ] [ 2.6653408 0.1620933 1.3538199 ] [ 2.2707382 2.1697724 2.2045096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.639568e-11 1.1919004e-10 8.696788e-11 ] [ 1.1162123e-10 4.1719e-11 2.9156252e-10 ] [ 1.107468e-11 2.3728572e-10 2.6179313e-10 ] [ 2.6653588e-10 1.9521843e-10 4.24139e-12 ] [ 2.6653408e-10 1.620933e-11 1.3538199e-10 ] [ 2.2707382e-10 2.1697724e-10 2.2045096e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.2e-05 1.35e-05 -3.3e-05 ] [ 3.69e-05 2.04e-05 -2.52e-05 ] [ -2.7e-06 -2.95e-05 -2.99e-05 ] [ -3.51e-05 2.63e-05 1.51e-05 ] [ -1.96e-05 -1.84e-05 6.18e-05 ] [ 6.25e-05 -1.24e-05 1.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.72914180736e-14 2.16293843808e-14 -5.28718284864e-14 ] [ 5.912031730752001e-14 3.268440306432e-14 -4.037485084416e-14 ] [ -4.32587687616e-15 -4.72642103136e-14 -4.790508096192e-14 ] [ -5.623639939008e-14 4.213724512704e-14 2.419286697408e-14 ] [ -3.140266176767999e-14 -2.948004982272e-14 9.901451516544e-14 ] [ 1.001360388e-13 -1.986699009792e-14 1.778416049088e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }