{ "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" [ [ 0.4264597 0.3568663 1.24612 ] [ 0.1993437 1.82063 0.3429825 ] [ 0.3583889 1.799016 2.47518 ] [ 1.901803 0.1168384 0.4528213 ] [ 1.669099 0.8043485 2.197104 ] [ 2.479285 2.402454 1.01494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.264597e-11 3.568663e-11 1.24612e-10 ] [ 1.993437e-11 1.82063e-10 3.429825e-11 ] [ 3.583889e-11 1.799016e-10 2.47518e-10 ] [ 1.901803e-10 1.168384e-11 4.528213e-11 ] [ 1.669099e-10 8.043485000000001e-11 2.197104e-10 ] [ 2.479285e-10 2.402454e-10 1.01494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -48.8571499 -38.4276828 -8.1377015 ] [ -22.5715827 33.2455657 -20.5493445 ] [ -25.6327494 30.733043 22.5166639 ] [ 37.959611 -32.8275568 -28.4654943 ] [ 50.9626098 -4.288187 33.1882393 ] [ 8.1392612 11.5648179 1.447637 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.827778332870106e-08 -6.156793497367828e-08 -1.303803509034909e-08 ] [ -3.616366209639374e-08 5.326526810981039e-08 -3.292367933066506e-08 ] [ -4.106819181550523e-08 4.923976298064109e-08 3.607567247899135e-08 ] [ 6.081800127886252e-08 -5.259554402294407e-08 -4.560674946697566e-08 ] [ 8.165110195651296e-08 -6.87043295701849e-09 5.317342109197576e-08 ] [ 1.304053400522455e-08 1.852888086318935e-08 2.31937015680505e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 34.007316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.448572663135778e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5382467 0.470179 0.479362 ] [ -0.7234521 2.2688893 0.3581185 ] [ -0.1367324 1.5689547 3.3611986 ] [ 2.2543294 -0.9069422 0.4560685 ] [ 1.7711448 1.7008968 2.2721321 ] [ 3.3308429 2.1981756 0.802268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.382467e-11 4.701790000000001e-11 4.79362e-11 ] [ -7.234521e-11 2.2688893e-10 3.581185e-11 ] [ -1.367324e-11 1.5689547e-10 3.3611986e-10 ] [ 2.2543294e-10 -9.069422e-11 4.560685e-11 ] [ 1.7711448e-10 1.7008968e-10 2.2721321e-10 ] [ 3.3308429e-10 2.1981756e-10 8.02268e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0106823 0.0092284 -0.0166884 ] [ -0.0119115 -0.0053539 0.0027854 ] [ 0.0529455 -0.0043631 -0.0182786 ] [ -0.0062862 -0.0113768 0.0029745 ] [ -0.095088 0.0058491 0.0613943 ] [ 0.0496578 0.0060162 -0.0321872 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.711493131637184e-11 1.478552672739072e-11 -2.673776431855872e-11 ] [ -1.90843268186592e-11 -8.57789341010112e-12 4.46270275957632e-12 ] [ 8.48280422765664e-11 -6.99045681421248e-12 -2.928554558095488e-11 ] [ -1.007160267367296e-11 -1.822764297951744e-11 4.765674358569601e-12 ] [ -1.523477705186304e-10 9.371291272721281e-12 9.836451211038144e-11 ] [ 7.956056620036226e-11 9.63901498605696e-12 -5.156957932901376e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.300443 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.810530557928301e-18 } }