{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.5775831 -0.9180294 4.7518589 ] [ -10.5404984 -0.9747676 -5.5442229 ] [ -3.7572073 -4.9252797 2.4515833 ] [ 1.3899561 1.6306993 -0.9477606 ] [ 3.3301664 5.1873774 -0.7114588 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.534497972658919e-08 -1.470845241887052e-09 7.613317234920406e-09 ] [ -1.688774010805981e-08 -1.561749859433326e-09 -8.882824310883977e-09 ] [ -6.019709695559093e-09 -7.891167986240838e-09 3.927869447203713e-09 ] [ 2.226955167358347e-09 2.612668294014925e-09 -1.51847987543538e-09 ] [ 5.335514749453701e-09 8.31109479354629e-09 -1.139882656022423e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3029507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.496263632794995e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.737447 1.9487638 0.9883323 ] [ 3.8430851 1.6117838 2.8616943 ] [ 4.1282483 2.4631157 4.8776432 ] [ 3.7464874 5.1244881 2.0725748 ] [ 4.5332492 4.4620075 4.0172475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.737447e-10 1.9487638e-10 9.883323000000001e-11 ] [ 3.8430851e-10 1.6117838e-10 2.8616943e-10 ] [ 4.1282483e-10 2.4631157e-10 4.8776432e-10 ] [ 3.7464874e-10 5.1244881e-10 2.0725748e-10 ] [ 4.5332492e-10 4.462007500000001e-10 4.0172475e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0994083 -0.1276462 0.0094003 ] [ -0.3317234 -0.4001519 -0.0371554 ] [ 0.3896245 0.5792409 -0.3138277 ] [ 0.061632 0.3980154 -0.2055759 ] [ -0.2189414 -0.4494581 0.5471586 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.592696541734727e-10 -2.04511757373961e-10 1.506094088850624e-11 ] [ -5.314794760522867e-10 -6.411140189486995e-10 -5.952951321647231e-11 ] [ 6.242472647908896e-10 9.280462277911506e-10 -5.028074038994362e-10 ] [ 9.874534949314561e-11 6.376909685983604e-10 -3.293689007799188e-10 ] [ -3.507827924052212e-10 -7.201112598491886e-10 8.766447167896589e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.030566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.607073833859137e-18 } }