{ "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" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.6148201 0.4084095 -4.624773 ] [ -0.1790314 0.0371461 0.0464936 ] [ -6.719226 9.2348562 3.5847031 ] [ 1.9422866 5.3004298 1.885786 ] [ -2.4946762 -10.1867824 5.7717244 ] [ 0.8358269 -4.7940592 -6.663934 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.059811011501792e-08 6.543441526126175e-10 -7.409703177107079e-09 ] [ -2.868399234690931e-10 5.951461297389889e-11 7.44909589368269e-11 ] [ -1.07653868070715e-08 1.479587070008993e-08 5.743327499329285e-09 ] [ 3.111886181413121e-09 8.49222470575162e-09 3.021362241031949e-09 ] [ -3.996911884106185e-09 -1.632102460245691e-08 9.247321895380908e-09 ] [ 1.33914231821574e-09 -7.680929568971153e-09 -1.067679925735423e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -13.062465 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.092837603301827e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6057739 -0.9020562 0.6693283 ] [ 0.4399811 3.896383 3.5197844 ] [ 2.5443527 0.4146264 0.1227543 ] [ 1.5946508 0.1228359 2.5996849 ] [ 2.538964 2.7378766 0.2903086 ] [ 1.9607076 2.4677096 2.5410679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.057739e-11 -9.020562e-11 6.693283e-11 ] [ 4.399811e-11 3.896383e-10 3.5197844e-10 ] [ 2.5443527e-10 4.146264e-11 1.227543e-11 ] [ 1.5946508e-10 1.228359e-11 2.5996849e-10 ] [ 2.538964e-10 2.7378766e-10 2.903086e-11 ] [ 1.9607076e-10 2.4677096e-10 2.5410679e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.66e-05 7.31e-05 2.68e-05 ] [ 4.4e-06 -1.93e-05 -9.8e-06 ] [ -3.49e-05 -2.34e-05 6.47e-05 ] [ 8.1e-06 3.12e-05 -7.33e-05 ] [ -2.4e-05 -1.69e-05 2.23e-05 ] [ -1e-07 -4.47e-05 -3.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.466143052928e-14 1.1711911098048e-13 4.293833343744e-14 ] [ 7.04957713152e-15 -3.092200878144e-14 -1.570133088384e-14 ] [ -5.591596406592e-14 -3.749093292672001e-14 1.0366082736576e-13 ] [ 1.297763062848e-14 4.998791056896e-14 -1.1743954630464e-13 ] [ -3.84522388992e-14 -2.707678489152e-14 3.572853864384e-14 ] [ -1.6021766208e-16 -7.161729494976001e-14 -4.934703992064001e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.970088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.879125486731863e-18 } }