{ "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" [ [ 3.052782 0.533749 2.863364 ] [ 2.918449 2.894241 2.581593 ] [ 2.15775 1.828991 4.761683 ] [ 4.980199 1.864144 2.667187 ] [ 4.882978 3.954202 1.645371 ] [ 4.390119 4.230009 4.149708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.052782e-10 5.33749e-11 2.863364e-10 ] [ 2.918449e-10 2.894241e-10 2.581593e-10 ] [ 2.15775e-10 1.828991e-10 4.761683e-10 ] [ 4.980199e-10 1.864144e-10 2.667187e-10 ] [ 4.882978e-10 3.954202e-10 1.645371e-10 ] [ 4.390119000000001e-10 4.230009e-10 4.149708000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1451643 0.5180665 0.6048043 ] [ -0.5481651 0.3551824 0.8954813 ] [ 1.0383454 0.4727609 -1.3590912 ] [ 0.4998093 -0.2317252 0.2003113 ] [ -0.1907064 0.108492 0.797107 ] [ -0.6541188 -1.2227766 -1.1386126 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.325788495509661e-10 8.300340411581609e-10 9.690033176027261e-10 ] [ -8.782573147942732e-10 5.690649420880416e-10 1.434719215043944e-09 ] [ 1.663612737901383e-09 7.574464674488105e-10 -2.177504164115021e-09 ] [ 8.007827819158961e-10 -3.712647009489768e-10 3.209340843861642e-10 ] [ -3.055453380342576e-10 1.73823347375928e-10 1.277106210197838e-09 ] [ -1.048013857220119e-09 -1.959104097121964e-09 -1.824258502897988e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.463799 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.477573743067256e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2229656 0.8093318 2.9024886 ] [ 2.2479225 2.8495657 2.0881195 ] [ 2.4924476 2.4945742 4.452572 ] [ 5.3748307 1.8088002 2.8299895 ] [ 4.3997875 3.8490394 2.015644 ] [ 4.6443231 3.4940247 4.3800924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2229656e-10 8.093318000000001e-11 2.9024886e-10 ] [ 2.2479225e-10 2.8495657e-10 2.0881195e-10 ] [ 2.4924476e-10 2.4945742e-10 4.452572e-10 ] [ 5.3748307e-10 1.8088002e-10 2.8299895e-10 ] [ 4.399787500000001e-10 3.8490394e-10 2.015644e-10 ] [ 4.6443231e-10 3.4940247e-10 4.3800924e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 3.42e-05 -1.16e-05 ] [ 1.3e-06 3.5e-06 1.44e-05 ] [ 1.2e-05 -1.47e-05 -4.4e-06 ] [ 1.53e-05 -8.9e-06 1.17e-05 ] [ -7.7e-06 -2.18e-05 -2.3e-06 ] [ -1.55e-05 7.7e-06 -7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.811971486999999e-15 5.479444088279999e-14 -1.85852489544e-14 ] [ 2.0828296242e-15 5.607618218999999e-15 2.30713435296e-14 ] [ 1.9226119608e-14 -2.35519965198e-14 -7.0495771896e-15 ] [ 2.45133025002e-14 -1.42593720426e-14 1.87454666178e-14 ] [ -1.23367600818e-14 -3.492745062119999e-14 -3.685006258199999e-15 ] [ -2.4833737827e-14 1.23367600818e-14 -1.24969777452e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014505636701e-18 } }