{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.110903 -24.154049 -7.4510576 ] [ -18.6210575 -24.0902671 -0.924617 ] [ -36.231728 15.1313461 21.6503412 ] [ -0.7008236 23.601368 6.1959471 ] [ 7.2070164 -0.5051433 -16.9390789 ] [ 42.3759526 -17.7443805 18.13484 ] [ 10.0815432 27.7611258 -20.666375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.586392731240502e-09 -3.869905292429106e-08 -1.193791038530812e-08 ] [ -2.983422322687045e-08 -3.859686305443894e-08 -1.481399752799178e-09 ] [ -5.804962801104354e-08 2.424308916238702e-08 3.468767078876752e-08 ] [ -1.122843196475762e-09 3.78135603400353e-08 9.92700166912006e-09 ] [ 1.154691327693479e-08 -8.09328792081652e-10 -2.713939641506242e-08 ] [ 6.789376109921153e-08 -2.842963182190523e-08 2.905521690932856e-08 ] [ 1.615241294970159e-08 4.447822709029455e-08 -3.311118313448175e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0808722 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.140454719180174e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5023432 1.2461287 1.8448825 ] [ 2.4228157 0.259089 4.0992084 ] [ 2.3576981 2.6979772 5.1381137 ] [ 1.4395244 3.5981528 2.8467932 ] [ 4.1162988 1.1577165 2.0957413 ] [ 4.7646417 1.5002854 4.7164201 ] [ 4.0511631 3.5966093 3.1346329 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5023432e-10 1.2461287e-10 1.8448825e-10 ] [ 2.4228157e-10 2.59089e-11 4.0992084e-10 ] [ 2.3576981e-10 2.6979772e-10 5.1381137e-10 ] [ 1.4395244e-10 3.5981528e-10 2.8467932e-10 ] [ 4.1162988e-10 1.1577165e-10 2.0957413e-10 ] [ 4.764641700000001e-10 1.5002854e-10 4.7164201e-10 ] [ 4.0511631e-10 3.5966093e-10 3.1346329e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-06 1.39e-05 -1.6e-06 ] [ 2.4e-06 1.2e-06 7.1e-06 ] [ 4e-06 -6.1e-06 -1.34e-05 ] [ 5.4e-06 -1.24e-05 -9.6e-06 ] [ -1.27e-05 5.3e-06 -3.2e-06 ] [ 1.26e-05 2e-06 1.33e-05 ] [ -5.6e-06 -3.9e-06 7.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999999e-15 2.22702552126e-14 -2.5634826144e-15 ] [ 3.845223921599999e-15 1.9226119608e-15 1.13754541014e-14 ] [ 6.408706535999999e-15 -9.773277467399999e-15 -2.14691668956e-14 ] [ 8.6517538236e-15 -1.98669902616e-14 -1.53808956864e-14 ] [ -2.03476432518e-14 8.4915361602e-15 -5.1269652288e-15 ] [ 2.01874255884e-14 3.204353268e-15 2.13089492322e-14 ] [ -8.972189150399999e-15 -6.248488872599999e-15 1.2016324755e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.900855 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.989556804762207e-18 } }