{ "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" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6899075 -13.1419315 -17.0660877 ] [ -15.6846168 -20.7101692 5.088921 ] [ -21.6779157 19.5626825 12.8223173 ] [ 17.1845862 3.851008 -33.0004482 ] [ 20.5199481 -24.9499287 19.4484074 ] [ 10.3479057 35.3883388 12.7068902 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.712711987501458e-08 -2.105569540145508e-08 -2.734288672146245e-08 ] [ -2.512952634316691e-08 -3.318134890505224e-08 8.153350251298158e-09 ] [ -3.473184972221327e-08 3.13428725416333e-08 2.054361700253938e-08 ] [ 2.753274224776231e-08 6.169994984113766e-09 -5.287254658196144e-08 ] [ 3.287658110584938e-08 -3.997419245376694e-08 3.115978364807372e-08 ] [ 1.657917258678306e-08 5.669836907430953e-08 2.035868240151263e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.92413255062208e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8160573 0.0134737 0.1392963 ] [ 0.4634786 -0.1182029 2.3735052 ] [ 0.1298177 2.0667744 2.8713783 ] [ 2.7576556 1.1388647 0.4675841 ] [ 2.7070108 0.1657116 2.7236662 ] [ 2.283224 2.5584193 2.3563935 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.160573000000001e-11 1.34737e-12 1.392963e-11 ] [ 4.634786000000001e-11 -1.182029e-11 2.3735052e-10 ] [ 1.298177e-11 2.0667744e-10 2.8713783e-10 ] [ 2.7576556e-10 1.1388647e-10 4.675841e-11 ] [ 2.7070108e-10 1.657116e-11 2.7236662e-10 ] [ 2.283224e-10 2.5584193e-10 2.3563935e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 1.06e-05 6e-06 ] [ -1.6e-06 -1.34e-05 2.6e-06 ] [ -1.3e-06 1.74e-05 -5.4e-06 ] [ -8e-07 1.07e-05 -1.2e-05 ] [ 1.21e-05 -1.48e-05 1.58e-05 ] [ -1.12e-05 -1.05e-05 -7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 1.698307218048e-14 9.6130597248e-15 ] [ -2.56348259328e-15 -2.146916671872e-14 4.16565921408e-15 ] [ -2.08282960704e-15 2.787787320192e-14 -8.65175375232e-15 ] [ -1.28174129664e-15 1.714328984256e-14 -1.92261194496e-14 ] [ 1.938633711168e-14 -2.371221398784e-14 2.531439060864e-14 ] [ -1.794437815296e-14 -1.68228545184e-14 -1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.421688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.829956148367191e-18 } }