{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2812016 -0.6998999 -1.3142793 ] [ -1.4719533 -1.1878937 1.466727 ] [ -3.3528391 0.6997258 -1.4884794 ] [ 1.9770221 4.1028299 0.5825173 ] [ 1.5665687 -2.9147622 0.7535144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.052711250051553e-09 -1.121363256680258e-09 -2.105707567661389e-09 ] [ -2.358329164169409e-09 -1.903215514135609e-09 2.349955708496122e-09 ] [ -5.371840419324114e-09 1.121084317730577e-09 -2.384806895222411e-09 ] [ 3.167538587424919e-09 6.573458144899201e-09 9.3329559927154e-10 ] [ 2.509919746017049e-09 -4.669963852031574e-09 1.20726315511614e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.755428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.88342719090977e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1568726 1.2544757 1.6872356 ] [ 0.0957629 1.3580889 2.8634292 ] [ 0.9971987 3.3382221 1.9101072 ] [ 2.7985306 4.170753 3.1294564 ] [ 3.9248731 2.1469053 2.9129826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1568726e-10 1.2544757e-10 1.6872356e-10 ] [ 9.57629e-12 1.3580889e-10 2.8634292e-10 ] [ 9.971987000000001e-11 3.3382221e-10 1.9101072e-10 ] [ 2.7985306e-10 4.170753000000001e-10 3.1294564e-10 ] [ 3.9248731e-10 2.1469053e-10 2.9129826e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.41e-05 4.1e-06 6.1e-06 ] [ -3.7e-06 -8e-06 7.7e-06 ] [ -1.9e-06 3.06e-05 -2.7e-06 ] [ 9e-06 -6.41e-05 -1.7e-05 ] [ -1.75e-05 3.75e-05 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.259069035328e-14 6.568924145279999e-15 9.77327738688e-15 ] [ -5.928053496960001e-15 -1.28174129664e-14 1.233675998016e-14 ] [ -3.04413557952e-15 4.902660459647999e-14 -4.32587687616e-15 ] [ 1.44195895872e-14 -1.0269952139328e-13 -2.72370025536e-14 ] [ -2.8038090864e-14 6.008162327999999e-14 9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.846295 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.218421013369993e-18 } }