{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.635666 1.500837 2.371006 ] [ 1.689283 2.814467 0.5645773 ] [ 2.46942 4.224913 2.374581 ] [ 3.374683 1.495269 0.2101847 ] [ 3.693559 1.840027 2.268425 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.635666e-10 1.500837e-10 2.371006e-10 ] [ 1.689283e-10 2.814467e-10 5.645773e-11 ] [ 2.46942e-10 4.224913e-10 2.374581e-10 ] [ 3.374683e-10 1.495269e-10 2.101847e-11 ] [ 3.693559e-10 1.840027e-10 2.268425e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2294199 -0.7193713 1.6643882 ] [ -1.0483271 4.5020594 2.5432472 ] [ -1.511669 -2.584004 -3.4433682 ] [ 2.0234674 -1.5369001 -4.1847542 ] [ 4.7659486 0.338216 3.4204869 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.776277683326274e-09 -1.152559878534503e-09 2.666643861975395e-09 ] [ -1.679605170571064e-09 7.213094316132876e-09 4.074731204755062e-09 ] [ -2.421960730188115e-09 -4.140030796853683e-09 -5.516884026846179e-09 ] [ 3.241952161230962e-09 -2.462385408725182e-09 -6.704715343034608e-09 ] [ 7.63589142285449e-09 5.418817679804928e-10 5.480224142932668e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.150937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.85488745741369e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3243786 0.4736374 4.0410119 ] [ 2.5544603 3.8573575 0.0986074 ] [ 1.391369 5.2736119 1.3201532 ] [ 3.375596 1.8151999 0.303398 ] [ 3.2168072 0.4557064 2.0256035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3243786e-10 4.736374e-11 4.0410119e-10 ] [ 2.5544603e-10 3.8573575e-10 9.86074e-12 ] [ 1.391369e-10 5.2736119e-10 1.3201532e-10 ] [ 3.375596e-10 1.8151999e-10 3.03398e-11 ] [ 3.2168072e-10 4.557064000000001e-11 2.0256035e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.2766845 -0.173876 -0.4564174 ] [ 0.3257079 -0.9886068 0.2699695 ] [ 0.1343746 -0.0362487 -0.2715459 ] [ -0.4919894 1.3559601 -0.2625505 ] [ -0.2447776 -0.1572287 0.7205443 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.432974372377376e-10 -2.785800621182208e-10 -7.312612876063219e-10 ] [ 5.218415825898643e-10 -1.583922702123901e-09 4.325388212290656e-10 ] [ 2.152918425493517e-10 -5.807681967439296e-11 -4.350644924540947e-10 ] [ -7.882539143614196e-10 2.17248757095763e-09 -4.206522728793505e-10 ] [ -3.921769480155341e-10 -2.519081472587769e-10 1.154439231710701e-09 ] ] } "relaxed-potential-energy" { "source-value" -10.848077 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.73805353500382e-18 } }