{ "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" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3875311 -16.7662651 3.5702118 ] [ -11.1543497 15.8057999 -4.2507342 ] [ 1.564946 -0.5700114 1.965737 ] [ -0.7159279 0.5378002 0.3860304 ] [ 10.7353567 -0.2176857 0.3665215 ] [ -0.8175563 1.210362 -2.0377664 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.208932682529069e-10 -2.686251796135497e-08 5.720109877264285e-09 ] [ -1.787123830956749e-08 2.532368307282298e-08 -6.810426956474992e-09 ] [ 2.507319894014477e-09 -9.132589386694771e-10 3.14945786404153e-09 ] [ -1.14704294355844e-09 8.616509071015641e-10 6.184888817980724e-10 ] [ 1.719993752068864e-08 -3.487709392224826e-10 5.872321783205472e-10 ] [ -1.309869590047751e-09 1.93921369910473e-09 -3.264861684731782e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.491216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.841095761976289e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9646613 0.8158616 0.7667279 ] [ -0.3210631 2.955262 0.406475 ] [ 0.6378473 2.817781 2.7348881 ] [ 0.9130054 0.3638669 3.2472439 ] [ 2.1445145 3.1652845 0.6022671 ] [ 2.9162839 1.5446614 2.3788364 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.646613e-11 8.158616e-11 7.667279e-11 ] [ -3.210631e-11 2.955262e-10 4.06475e-11 ] [ 6.378473e-11 2.817781e-10 2.7348881e-10 ] [ 9.130054e-11 3.638669e-11 3.2472439e-10 ] [ 2.1445145e-10 3.1652845e-10 6.022671000000001e-11 ] [ 2.9162839e-10 1.5446614e-10 2.3788364e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.69e-05 -2e-07 1.95e-05 ] [ -1.31e-05 -7e-06 1.69e-05 ] [ 1.02e-05 -4.1e-06 -7.1e-06 ] [ -2e-06 2.54e-05 -3.77e-05 ] [ 9.6e-06 -2.4e-05 2e-05 ] [ -2.16e-05 9.9e-06 -1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.707678489152e-14 -3.2043532416e-16 3.12424441056e-14 ] [ -2.098851373248e-14 -1.12152363456e-14 2.707678489152e-14 ] [ 1.634220153216e-14 -6.568924145279999e-15 -1.137545400768e-14 ] [ -3.2043532416e-15 4.069528616832e-14 -6.040205860416e-14 ] [ 1.538089555968e-14 -3.84522388992e-14 3.2043532416e-14 ] [ -3.460701500928e-14 1.586154854592e-14 -1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }