{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.648594 -4.6899111 -8.8372351 ] [ -2.698649 -1.7405013 0.7204487 ] [ 4.8238263 -2.33355 6.1900147 ] [ -5.6700772 4.572247 -2.0704468 ] [ 5.2728365 0.1964306 -3.0320227 ] [ -0.7261991 -3.8628544 5.2681498 ] [ 4.6468565 7.8581392 1.7610915 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.050045247191156e-09 -7.514065918050411e-09 -1.415881146973315e-08 ] [ -4.3237123355453e-09 -2.788590491332007e-09 1.154286063625753e-09 ] [ 7.728621720660169e-09 -3.73875925346784e-09 9.917496834748326e-09 ] [ -9.084465127971125e-09 7.325547247922938e-09 -3.317221457570174e-09 ] [ 8.4480153656009e-09 3.147165149297165e-10 -4.857835883674893e-09 ] [ -1.163499220066001e-09 -6.188975009234411e-09 8.440506444432196e-09 ] [ 7.445084844512516e-09 1.259012690923202e-08 2.821579628389603e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.554786 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.851280798754715e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4894364 2.7899128 0.9410784 ] [ 1.2672182 2.0020306 2.9268658 ] [ 3.5787501 3.5906097 4.9043613 ] [ 1.430799 4.2892935 3.8147093 ] [ 4.6854895 2.1958566 1.9963701 ] [ 3.4056514 1.3434791 3.915241 ] [ 3.6164684 4.4570067 2.5067342 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.489436400000001e-10 2.789912800000001e-10 9.410784e-11 ] [ 1.2672182e-10 2.0020306e-10 2.9268658e-10 ] [ 3.5787501e-10 3.5906097e-10 4.904361299999999e-10 ] [ 1.430799e-10 4.2892935e-10 3.8147093e-10 ] [ 4.6854895e-10 2.1958566e-10 1.9963701e-10 ] [ 3.4056514e-10 1.3434791e-10 3.915241e-10 ] [ 3.6164684e-10 4.4570067e-10 2.5067342e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 -9.6e-06 1.24e-05 ] [ 1.74e-05 -5.3e-06 -1.27e-05 ] [ 3.2e-06 1.41e-05 -4.8e-06 ] [ -6.6e-06 1.4e-05 1.65e-05 ] [ 5.1e-06 -5.9e-06 4e-06 ] [ -1.28e-05 -3.2e-06 -1.94e-05 ] [ -4.7e-06 -4.1e-06 4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 -1.538089555968e-14 1.986699009792e-14 ] [ 2.787787320192e-14 -8.491536090240001e-15 -2.034764308416e-14 ] [ 5.126965186560001e-15 2.259069035328e-14 -7.69044777984e-15 ] [ -1.057436569728e-14 2.24304726912e-14 2.64359142432e-14 ] [ 8.17110076608e-15 -9.45284206272e-15 6.4087064832e-15 ] [ -2.050786074624e-14 -5.126965186560001e-15 -3.108222644352e-14 ] [ -7.53023011776e-15 -6.568924145279999e-15 6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.30807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.933276172596986e-18 } }