{ "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" [ [ 1.059811020233354e-08 6.543441580036229e-10 -7.409703238154082e-09 ] [ -2.868399258323076e-10 5.95146134642274e-11 7.44909595505424e-11 ] [ -1.076538689576528e-08 1.479587082199003e-08 5.743327546647364e-09 ] [ 3.111886207051304e-09 8.492224775717292e-09 3.021362265924324e-09 ] [ -3.99691191703591e-09 -1.632102473692244e-08 9.24732197156767e-09 ] [ 1.339142329248655e-09 -7.680929632252733e-09 -1.067679934531815e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -13.062465 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.092837620544281e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6057739 -0.9020563 0.6693283 ] [ 0.4399811 3.896383 3.5197844 ] [ 2.5443527 0.4146264 0.1227543 ] [ 1.5946507 0.1228359 2.5996849 ] [ 2.538964 2.7378766 0.2903086 ] [ 1.9607075 2.4677096 2.5410679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.057739e-11 -9.020563e-11 6.693283e-11 ] [ 4.399811e-11 3.896383e-10 3.5197844e-10 ] [ 2.5443527e-10 4.146264e-11 1.227543e-11 ] [ 1.5946507e-10 1.228359e-11 2.5996849e-10 ] [ 2.538964e-10 2.7378766e-10 2.903086e-11 ] [ 1.9607075e-10 2.4677096e-10 2.5410679e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.66e-05 7.32e-05 2.69e-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 -7.34e-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" [ [ 7.466143114439999e-14 1.172793296088e-13 4.309855145459999e-14 ] [ 7.0495771896e-15 -3.09220090362e-14 -1.57013310132e-14 ] [ -5.59159645266e-14 -3.749093323559999e-14 1.036608282198e-13 ] [ 1.29776307354e-14 4.998791098079999e-14 -1.175997649356e-13 ] [ -3.8452239216e-14 -2.70767851146e-14 3.572853893819999e-14 ] [ -1.602176634e-16 -7.16172955398e-14 -4.93470403272e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.970088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.879125510452379e-18 } }