{ "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" [ [ 0.468554 0.0062453 1.779472 ] [ 0.0137549 1.819656 0.3703857 ] [ 0.6368997 2.724291 2.946976 ] [ 2.361208 0.5254432 0.0878272 ] [ 1.952332 1.317185 1.267695 ] [ 2.764287 2.133831 2.76552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.685540000000001e-11 6.2453e-13 1.779472e-10 ] [ 1.37549e-12 1.819656e-10 3.703857e-11 ] [ 6.368997e-11 2.724291e-10 2.946976e-10 ] [ 2.361208e-10 5.254432e-11 8.782719999999999e-12 ] [ 1.952332e-10 1.317185e-10 1.267695e-10 ] [ 2.764287e-10 2.133831e-10 2.76552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.1464769 -9.6537045 4.1723302 ] [ -5.5705729 4.7490687 -1.5162457 ] [ -4.2235533 1.5771683 -1.3060155 ] [ 18.7512921 -33.4167254 -50.5393648 ] [ -11.5591239 31.3721743 38.1987784 ] [ 9.748435 5.3720187 10.9905174 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.144991830460075e-08 -1.546693978144065e-08 6.684809955772547e-09 ] [ -8.925041738373619e-09 7.608846904400754e-09 -2.429293431942974e-09 ] [ -6.766878409713591e-09 2.526902198145502e-09 -2.092467517741827e-09 ] [ 3.004288205992879e-08 -5.353949662067429e-08 -8.097298937976208e-08 ] [ -1.851975822209095e-08 5.02637646212353e-08 6.12011901998239e-08 ] [ 1.561871477506779e-08 8.606922838551054e-09 1.760875017385043e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.009991 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.084430358875029e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1345665 -0.4690105 1.6005213 ] [ -0.2687672 1.9931976 1.2718833 ] [ 0.6157563 3.5372722 2.8482788 ] [ 3.3108028 0.3306009 -0.6074434 ] [ 2.0094505 0.7606916 1.2378651 ] [ 2.6643597 2.3738998 2.8667707 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.345665e-11 -4.690105e-11 1.6005213e-10 ] [ -2.687672e-11 1.9931976e-10 1.2718833e-10 ] [ 6.157563e-11 3.5372722e-10 2.8482788e-10 ] [ 3.3108028e-10 3.306009e-11 -6.074434e-11 ] [ 2.0094505e-10 7.606916000000001e-11 1.2378651e-10 ] [ 2.6643597e-10 2.3738998e-10 2.8667707e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.8e-06 -1e-07 -1.2e-06 ] [ 7e-06 -1e-07 3e-07 ] [ 5e-07 3.3e-06 5e-06 ] [ 1e-07 7.4e-06 3.7e-06 ] [ 5e-07 -1.34e-05 3.1e-06 ] [ -4.4e-06 2.9e-06 -1.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.088271209199999e-15 -1.602176634e-16 -1.9226119608e-15 ] [ 1.1215236438e-14 -1.602176634e-16 4.806529901999999e-16 ] [ 8.010883169999999e-16 5.2871828922e-15 8.010883169999999e-15 ] [ 1.602176634e-16 1.18561070916e-14 5.9280535458e-15 ] [ 8.010883169999999e-16 -2.14691668956e-14 4.9667475654e-15 ] [ -7.0495771896e-15 4.6463122386e-15 -1.7623942974e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.786238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.208798839436289e-18 } }