{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.0615098 -0.4327869 -3.0310341 ] [ -5.7036969 2.1416502 5.1779672 ] [ 1.4030679 -5.0483795 -0.8450943 ] [ 6.4313797 -0.2464873 13.5243523 ] [ -0.8389497 1.6140375 0.5132927 ] [ 7.8920206 1.3857864 -16.6870798 ] [ -0.1223119 0.5861796 1.347596 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.451813927032201e-08 -6.934010586812946e-10 -4.856252011877219e-09 ] [ -9.138329900598233e-09 3.431301908641427e-09 8.296018059458404e-09 ] [ 2.247962605295448e-09 -8.088395674464602e-09 -1.353990340986586e-09 ] [ 1.030420627972193e-08 -3.949161926377482e-10 2.166840124504415e-08 ] [ -1.34414560644131e-09 2.585973168899775e-09 8.223855703427719e-10 ] [ 1.264441100036666e-08 2.220274589794977e-09 -2.673564934525339e-08 ] [ -1.959652682401446e-10 9.391632584474663e-10 2.159086823271864e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.562784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.493432888478905e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6449374 2.824772 1.4718634 ] [ 2.3309287 2.7415281 3.9102876 ] [ 3.5432717 1.2598616 2.0807975 ] [ 4.9549211 2.909767 3.5964465 ] [ 3.1932567 4.6856182 0.9908311 ] [ 5.0328754 3.042 1.0666519 ] [ 3.4675761 4.9550342 3.4287809 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6449374e-10 2.824772e-10 1.4718634e-10 ] [ 2.3309287e-10 2.7415281e-10 3.910287600000001e-10 ] [ 3.5432717e-10 1.2598616e-10 2.0807975e-10 ] [ 4.9549211e-10 2.909767e-10 3.5964465e-10 ] [ 3.1932567e-10 4.6856182e-10 9.908311e-11 ] [ 5.0328754e-10 3.042e-10 1.0666519e-10 ] [ 3.4675761e-10 4.9550342e-10 3.4287809e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 1.95e-05 -2.8e-06 ] [ -7.8e-06 -6.1e-06 3.5e-06 ] [ 4.6e-06 -1.1e-06 1.4e-06 ] [ 1.12e-05 1.8e-06 1.02e-05 ] [ -6.7e-06 -6.4e-06 1.72e-05 ] [ 3.4e-06 -2.5e-06 -7.6e-06 ] [ -5.1e-06 -5.2e-06 -2.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.806529901999999e-16 3.1242444363e-14 -4.486094575199999e-15 ] [ -1.24969777452e-14 -9.773277467399999e-15 5.607618218999999e-15 ] [ 7.370012516399999e-15 -1.7623942974e-15 2.2430472876e-15 ] [ 1.79443783008e-14 2.8839179412e-15 1.63422016668e-14 ] [ -1.07345834478e-14 -1.02539304576e-14 2.75574381048e-14 ] [ 5.4474005556e-15 -4.005441585e-15 -1.21765424184e-14 ] [ -8.1711008334e-15 -8.331318496799998e-15 -3.50876682846e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759062264992e-18 } }