{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7314565 -12.7903918 -13.5209606 ] [ -3.7076472 4.04626 -4.5687483 ] [ 20.6373554 -13.3659754 0.8138902 ] [ -13.7190251 11.3904381 16.3042731 ] [ 7.5207735 10.7196692 0.9715456 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.71936887114322e-08 -2.049246671283203e-08 -2.166296696407794e-08 ] [ -5.940305662014582e-09 6.482823173678209e-09 -7.319941712579745e-09 ] [ 3.306468833702064e-08 -2.141465330006793e-08 1.303995850338236e-09 ] [ -2.198030127538838e-08 1.824949362448957e-08 2.612232517995834e-08 ] [ 1.204960747203219e-08 1.717480337494984e-08 1.556587646361108e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.102625 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.77883662045096e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4616274 0.1799796 0.7718897 ] [ -0.0058066 1.8596037 1.5532573 ] [ 3.5150676 0.4132124 1.9181951 ] [ 1.1406329 3.13075 3.1826421 ] [ 3.3167593 2.2370294 3.4079609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4616274e-10 1.799796e-11 7.718897000000001e-11 ] [ -5.806600000000001e-13 1.8596037e-10 1.5532573e-10 ] [ 3.5150676e-10 4.132124e-11 1.9181951e-10 ] [ 1.1406329e-10 3.13075e-10 3.1826421e-10 ] [ 3.316759300000001e-10 2.2370294e-10 3.4079609e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 1.25e-05 7.1e-06 ] [ 4.6e-06 -1.06e-05 3.4e-06 ] [ 5.4e-06 7e-06 1.9e-06 ] [ 4.9e-06 6.5e-06 -6.7e-06 ] [ -1.17e-05 -1.54e-05 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 2.002720776e-14 1.137545400768e-14 ] [ 7.370012455680001e-15 -1.698307218048e-14 5.44740051072e-15 ] [ 8.65175375232e-15 1.12152363456e-14 3.04413557952e-15 ] [ 7.850665441919999e-15 1.04141480352e-14 -1.073458335936e-14 ] [ -1.874546646336e-14 -2.467351996032e-14 -9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.0960126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.136906548862222e-18 } }