{ "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" [ [ -3.9071352 -4.7097962 -1.9090286 ] [ -8.018285 -0.556547 1.472489 ] [ -0.446556 2.9853867 4.2845065 ] [ -0.3443621 -1.2716242 -0.5074276 ] [ 12.6947426 1.6450494 -2.118364 ] [ 0.0215958 1.9075312 -1.2221753 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.259920723318916e-09 -7.54592542254199e-09 -3.058601016557732e-09 ] [ -1.284670887175269e-08 -8.916865991227979e-10 2.359187469622025e-09 ] [ -7.154615889725039e-10 4.783116814194367e-09 6.864536202521121e-09 ] [ -5.517289102551713e-10 -2.037366580468942e-09 -8.129886441666982e-10 ] [ 2.033921996836441e-08 2.635659710455719e-09 -3.393993303106776e-09 ] [ 3.460028615253719e-11 3.05620191726598e-09 -1.95814070831194e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7127269 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.556150409160325e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0292365 0.4404213 0.9926934 ] [ 0.1642263 2.7441239 0.6489186 ] [ 0.3642616 3.4454649 3.090143 ] [ 1.5082135 0.0334569 2.3211443 ] [ 2.687995 2.8982119 0.3354174 ] [ 2.5013163 2.1010384 2.7481216 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.92365e-12 4.404213000000001e-11 9.926934e-11 ] [ 1.642263e-11 2.7441239e-10 6.489186000000001e-11 ] [ 3.642616e-11 3.4454649e-10 3.090143e-10 ] [ 1.5082135e-10 3.34569e-12 2.3211443e-10 ] [ 2.687995e-10 2.8982119e-10 3.354174e-11 ] [ 2.5013163e-10 2.1010384e-10 2.7481216e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.97e-05 7.8e-06 4.75e-05 ] [ -2.06e-05 3e-07 2.8e-06 ] [ -1.2e-05 -2.42e-05 0.0 ] [ -2.89e-05 4.24e-05 -4.27e-05 ] [ 2.58e-05 -2.4e-05 7.7e-06 ] [ -3.9e-06 -2.2e-06 -1.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.36064123698e-14 1.24969777452e-14 7.6103390115e-14 ] [ -3.300483866039999e-14 4.806529901999999e-16 4.486094575199999e-15 ] [ -1.9226119608e-14 -3.877267454279999e-14 0.0 ] [ -4.63029047226e-14 6.79322892816e-14 -6.84129422718e-14 ] [ 4.133615715719999e-14 -3.8452239216e-14 1.23367600818e-14 ] [ -6.248488872599999e-15 -3.5247885948e-15 -2.46735201636e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.314433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453642671555852e-18 } }