{ "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" [ [ 1.1266459 -23.812712 6.4172712 ] [ -15.3944291 22.6644506 -5.1715107 ] [ 0.3210315 1.1005252 2.2904374 ] [ -0.384265 -0.6981624 -0.7981171 ] [ 14.7816072 -0.5035222 -2.3034385 ] [ -0.4505905 1.2494208 -0.4346424 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.805085720900175e-09 -3.815217044424361e-08 1.028160188597316e-08 ] [ -2.466459439458319e-08 3.631245287459653e-08 -8.285673537757042e-09 ] [ 5.143491638403552e-10 1.763235746041244e-09 3.669685253685938e-09 ] [ -6.15660399191712e-10 -1.118579474801618e-09 -1.278724558280696e-09 ] [ 2.368274547368895e-08 -8.067314968937818e-10 -3.690515312150621e-09 ] [ -7.219255646545824e-10 2.001792795301233e-09 -6.96373891688402e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.8545854 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.175726610757017e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3368578 0.9181283 1.1495059 ] [ 0.0137064 3.4189472 0.2994703 ] [ 0.2137257 2.970638 2.7699579 ] [ 1.8357552 -0.1914985 2.725196 ] [ 2.3292457 2.4307694 0.377409 ] [ 2.5259584 2.1157329 2.8148992 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.368578e-11 9.181283000000001e-11 1.1495059e-10 ] [ 1.37064e-12 3.4189472e-10 2.994703e-11 ] [ 2.137257e-11 2.970638e-10 2.7699579e-10 ] [ 1.8357552e-10 -1.914985e-11 2.725196e-10 ] [ 2.3292457e-10 2.4307694e-10 3.77409e-11 ] [ 2.5259584e-10 2.1157329e-10 2.8148992e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0008367 0.0004427 0.000629 ] [ -2.44e-05 -1.3e-06 -1.58e-05 ] [ 2.56e-05 -4.79e-05 -8.5e-05 ] [ -4.67e-05 0.0001136 -4.81e-05 ] [ -8.78e-05 -7.4e-06 3.74e-05 ] [ -0.0007034 -0.0004995 -0.0005176 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.34054117862336e-12 7.0928359002816e-13 1.0077690944832e-12 ] [ -3.909310954752e-14 -2.08282960704e-15 -2.531439060864e-14 ] [ 4.101572149248001e-14 -7.674426013632e-14 -1.36185012768e-13 ] [ -7.482164819136e-14 1.8200726412288e-13 -7.706469546047999e-14 ] [ -1.4067110730624e-13 -1.185610699392e-14 5.992140561792e-14 ] [ -1.12697103507072e-12 -8.002872220896001e-13 -8.2928661892608e-13 ] ] } "relaxed-potential-energy" { "source-value" -13.876968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.223335369718974e-18 } }