{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9148038 -0.3501782 -1.4783962 ] [ 0.4093185 -2.0282431 -0.1101396 ] [ -1.4274197 0.8639572 -5.7625837 ] [ -0.6555253 -4.015501 5.0546997 ] [ 4.9067501 1.1258367 0.4675936 ] [ 1.3622497 3.0416552 -1.6985948 ] [ -0.6805696 1.3624731 3.527421 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.272207123378999e-09 -5.610473251538266e-10 -2.368651827919561e-09 ] [ 6.558005311609248e-10 -3.249603676118917e-09 -1.764630921442637e-10 ] [ -2.28697847140935e-09 1.38421202721183e-09 -9.232676879543162e-09 ] [ -1.050267310002906e-09 -6.433541822999022e-09 8.098521684504773e-09 ] [ 7.861480294328062e-09 1.803789239578623e-09 7.491675339557068e-10 ] [ 2.182564621031814e-09 4.873268849974748e-09 -2.721448876772452e-09 ] [ -1.090392701947208e-09 2.1829225472889e-09 5.651551457918957e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.464862 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.317526371949833e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6758986 3.5795235 1.9015168 ] [ 4.7718595 1.5049441 2.2048899 ] [ 2.9855299 1.939976 0.7162526 ] [ 3.7228235 1.6981129 4.3156177 ] [ 6.1480942 3.4283371 2.1518323 ] [ 4.8384663 5.067893 3.3370877 ] [ 2.8812708 3.8718223 3.9159425 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6758986e-10 3.5795235e-10 1.9015168e-10 ] [ 4.7718595e-10 1.5049441e-10 2.2048899e-10 ] [ 2.9855299e-10 1.939976e-10 7.162526e-11 ] [ 3.7228235e-10 1.6981129e-10 4.3156177e-10 ] [ 6.148094200000001e-10 3.4283371e-10 2.1518323e-10 ] [ 4.8384663e-10 5.067892999999999e-10 3.3370877e-10 ] [ 2.8812708e-10 3.8718223e-10 3.9159425e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 8.3e-06 -9.7e-06 ] [ 9.9e-06 8.3e-06 3.1e-06 ] [ -1.31e-05 2.6e-06 -3.4e-06 ] [ 1.89e-05 8.8e-06 8.4e-06 ] [ -6.8e-06 -1.09e-05 3.1e-06 ] [ -1.6e-06 -8e-06 5e-06 ] [ -7.9e-06 -9.1e-06 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-16 1.329806595264e-14 -1.554111322176e-14 ] [ 1.586154854592e-14 1.329806595264e-14 4.96674752448e-15 ] [ -2.098851373248e-14 4.16565921408e-15 -5.44740051072e-15 ] [ 3.028113813312e-14 1.409915426304e-14 1.345828361472e-14 ] [ -1.089480102144e-14 -1.746372516672e-14 4.96674752448e-15 ] [ -2.56348259328e-15 -1.28174129664e-14 8.010883104e-15 ] [ -1.265719530432e-14 -1.457980724928e-14 -1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }