{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.744807 -1.9094068 1.2352476 ] [ 2.3053552 4.8301999 2.3172897 ] [ -4.647096 0.1057097 2.0026555 ] [ -2.3324187 0.9343422 -3.9576786 ] [ 0.6988087 -4.7378039 -4.1020311 ] [ 1.4877032 2.6016275 -4.0336615 ] [ 3.2324547 -1.8246686 6.5381784 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.193312362408186e-09 -3.059206934556541e-09 1.97908482561931e-09 ] [ 3.693586204079708e-09 7.738833353570498e-09 3.712707380960645e-09 ] [ -7.445468565813197e-09 1.693656099317818e-10 3.208607821616534e-09 ] [ -3.736946711056729e-09 1.496981228666838e-09 -6.340900125560475e-09 ] [ 1.119614961551641e-09 -7.590798642515062e-09 -6.572178326214507e-09 ] [ 2.383563285729346e-09 4.168266756530352e-09 -6.46263815152106e-09 ] [ 5.178963348135078e-09 -2.923441371627867e-09 1.047531657509955e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -20.906411 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.349576292903595e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.964009 1.6911142 2.9970286 ] [ 2.0159271 3.6702081 1.3681015 ] [ 1.323137 3.8883501 3.8268324 ] [ 2.8829239 5.520804 2.9161736 ] [ 3.9198793 1.9656058 1.5735257 ] [ 4.4877979 4.3324828 1.5235548 ] [ 3.8151688 3.2891321 3.7667454 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.964009e-10 1.6911142e-10 2.9970286e-10 ] [ 2.0159271e-10 3.6702081e-10 1.3681015e-10 ] [ 1.323137e-10 3.8883501e-10 3.8268324e-10 ] [ 2.8829239e-10 5.520804e-10 2.9161736e-10 ] [ 3.9198793e-10 1.9656058e-10 1.5735257e-10 ] [ 4.487797900000001e-10 4.3324828e-10 1.5235548e-10 ] [ 3.8151688e-10 3.2891321e-10 3.7667454e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.63e-05 2.89e-05 -9e-07 ] [ 2.8e-05 1.55e-05 1.59e-05 ] [ -1.62e-05 8e-06 3.4e-06 ] [ -2.92e-05 -1.52e-05 1.21e-05 ] [ 6.5e-06 -1.29e-05 -1.16e-05 ] [ -8.1e-06 -2.82e-05 -5.8e-06 ] [ 2.7e-06 4e-06 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.611547891904e-14 4.630290434112001e-14 -1.44195895872e-15 ] [ 4.48609453824e-14 2.48337376224e-14 2.547460827072e-14 ] [ -2.595526125696e-14 1.28174129664e-14 5.44740051072e-15 ] [ -4.678355732736e-14 -2.435308463616e-14 1.938633711168e-14 ] [ 1.04141480352e-14 -2.066807840832e-14 -1.858524880128e-14 ] [ -1.297763062848e-14 -4.518138070656001e-14 -9.292624400640001e-15 ] [ 4.32587687616e-15 6.4087064832e-15 -2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }