{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7265926 -3.1222929 0.5365028 ] [ -2.7971829 4.1854705 -3.3725157 ] [ -8.3805299 6.6024588 6.2073987 ] [ 1.9831902 -8.8733826 -6.1447548 ] [ 5.1789206 -6.9821107 6.5804958 ] [ 4.7492945 4.2801444 -4.0236061 ] [ 3.9929001 3.9097125 0.2164792 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.572836159766287e-09 -5.002464687669832e-09 8.595722431537382e-10 ] [ -4.481581046481545e-09 6.705862982148087e-09 -5.403365807820947e-09 ] [ -1.342708907569536e-08 1.057830512915522e-08 9.945349073124312e-09 ] [ 3.177420973039676e-09 -1.421672614913352e-08 -9.84498248110858e-09 ] [ 8.297545506299508e-09 -1.118657452737752e-08 1.054311652403259e-08 ] [ 7.609208613194026e-09 6.857547291328044e-09 -6.446527624728268e-09 ] [ 6.397331189409982e-09 6.264049961549519e-09 3.468379131294874e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.733368 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.040110451364286e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3672119 1.8503606 2.4407836 ] [ 1.8280706 4.1145534 1.2336894 ] [ 1.894318 3.9615887 3.8352843 ] [ 3.6079689 1.1506751 1.9574078 ] [ 4.692664 1.5326429 4.0598514 ] [ 4.1378163 3.4604566 1.3509486 ] [ 4.2881883 3.8751647 3.7569868 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3672119e-10 1.8503606e-10 2.4407836e-10 ] [ 1.8280706e-10 4.1145534e-10 1.2336894e-10 ] [ 1.894318e-10 3.9615887e-10 3.8352843e-10 ] [ 3.6079689e-10 1.1506751e-10 1.9574078e-10 ] [ 4.692664e-10 1.5326429e-10 4.0598514e-10 ] [ 4.1378163e-10 3.4604566e-10 1.3509486e-10 ] [ 4.2881883e-10 3.8751647e-10 3.7569868e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 1.28e-05 2.4e-06 ] [ 9.1e-06 -6.9e-06 2.69e-05 ] [ -5.3e-06 -3.5e-06 -8e-07 ] [ 8.5e-06 3.7e-06 1.8e-06 ] [ -4.8e-06 2.4e-06 7.9e-06 ] [ 9.7e-06 -1e-07 -3.95e-05 ] [ -1.7e-05 -8.5e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-16 2.050786074624e-14 3.84522388992e-15 ] [ 1.457980724928e-14 -1.105501868352e-14 4.309855109952001e-14 ] [ -8.491536090240001e-15 -5.6076181728e-15 -1.28174129664e-15 ] [ 1.36185012768e-14 5.928053496960001e-15 2.88391791744e-15 ] [ -7.69044777984e-15 3.84522388992e-15 1.265719530432e-14 ] [ 1.554111322176e-14 -1.6021766208e-16 -6.32859765216e-14 ] [ -2.72370025536e-14 -1.36185012768e-14 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }