{ "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" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0199581 -3.8029751 -1.2176087 ] [ -48.8284255 19.0908871 -33.6220377 ] [ -9.4158751 -3.8631477 9.652418 ] [ -8.5946426 -29.0368027 -0.3482148 ] [ 48.0811768 -8.5461277 17.972657 ] [ 15.7378084 26.1581661 7.5627862 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.838506303479035e-09 -6.093037844903813e-09 -1.950824208495115e-09 ] [ -7.823176241110976e-08 3.058697323395202e-08 -5.386844319040709e-08 ] [ -1.508589507388241e-08 -6.189444978630841e-09 1.546487858120101e-08 ] [ -1.377013555130101e-08 -4.652208681200811e-08 -5.579016161729831e-10 ] [ 7.703453800418289e-08 -1.369240611212016e-08 2.879537109629654e-08 ] [ 2.521474888884892e-08 4.19100025137109e-08 1.211691933757765e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.4280642 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.51054241650919e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0557623 -0.4087621 -0.0231985 ] [ 0.2162419 3.0218596 0.5568702 ] [ -0.439505 1.5041912 2.3440267 ] [ 1.7676207 0.4369654 2.3752182 ] [ 2.4738377 2.0714559 0.4504836 ] [ 3.3658352 2.3838727 2.8290057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0557623e-10 -4.087621e-11 -2.31985e-12 ] [ 2.162419e-11 3.0218596e-10 5.568702e-11 ] [ -4.39505e-11 1.5041912e-10 2.3440267e-10 ] [ 1.7676207e-10 4.369654e-11 2.3752182e-10 ] [ 2.4738377e-10 2.0714559e-10 4.504836e-11 ] [ 3.3658352e-10 2.3838727e-10 2.8290057e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.61e-05 -8.1e-06 3.28e-05 ] [ -4.23e-05 1.14e-05 2.41e-05 ] [ 2.19e-05 2.66e-05 -6.2e-06 ] [ 6.2e-06 1.9e-06 -5.62e-05 ] [ 1.49e-05 -2.41e-05 -7.7e-06 ] [ -1.68e-05 -7.6e-06 1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.579504380739999e-14 -1.29776307354e-14 5.255139359519999e-14 ] [ -6.77720716182e-14 1.82648136276e-14 3.86124568794e-14 ] [ 3.50876682846e-14 4.26178984644e-14 -9.9334951308e-15 ] [ 9.9334951308e-15 3.0441356046e-15 -9.004232683079999e-14 ] [ 2.38724318466e-14 -3.86124568794e-14 -1.23367600818e-14 ] [ -2.691656745119999e-14 -1.21765424184e-14 2.09885139054e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.838284 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.537572854745606e-18 } }