{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.638444 0.1037795 1.566109 ] [ 2.272296 0.012464 2.947777 ] [ 1.706904 2.720714 0.1698745 ] [ 2.81231 2.888436 1.350646 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.38444e-11 1.037795e-11 1.566109e-10 ] [ 2.272296e-10 1.2464e-12 2.947777e-10 ] [ 1.706904e-10 2.720714e-10 1.698745e-11 ] [ 2.81231e-10 2.888436e-10 1.350646e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.5388328 -0.9574692 3.1532047 ] [ -4.2287267 0.8465807 -3.7669499 ] [ -13.5142492 -2.6683938 -13.3763849 ] [ 14.2041432 2.7792823 13.9901301 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.669835177080202e-09 -1.534034767376079e-09 5.051990850936678e-09 ] [ -6.775167054492736e-09 1.356371805160498e-09 -6.035319061504899e-09 ] [ -2.16522141159051e-08 -4.275238161447671e-09 -2.143133115760215e-08 ] [ 2.27575461535353e-08 4.452901123663253e-09 2.241465936817036e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.677252 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.671990325359004e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7089268 -0.0451419 1.6098089 ] [ 2.1289767 0.1482561 2.8462817 ] [ 1.5860039 2.7144444 0.1709173 ] [ 3.0060467 2.907835 1.4073985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.089268e-11 -4.51419e-12 1.6098089e-10 ] [ 2.1289767e-10 1.482561e-11 2.8462817e-10 ] [ 1.5860039e-10 2.7144444e-10 1.709173e-11 ] [ 3.0060467e-10 2.907835e-10 1.4073985e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.41e-05 2.12e-05 1.84e-05 ] [ -3.63e-05 -6.57e-05 2.64e-05 ] [ 1.9e-06 2.78e-05 -1.4e-05 ] [ -9.7e-06 1.68e-05 -3.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.065598897728e-14 3.396614436096001e-14 2.948004982272e-14 ] [ -5.815901133504e-14 -1.0526300398656e-13 4.229746278912e-14 ] [ 3.04413557952e-15 4.454051005824e-14 -2.24304726912e-14 ] [ -1.554111322176e-14 2.691656722944e-14 -4.950725758272e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.845069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.179530558996284e-18 } }