{ "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" [ [ 0.563951 0.9225225 1.195567 ] [ 1.348432 0.3073599 2.755625 ] [ 0.2422324 2.903648 2.041824 ] [ 2.040932 0.0344744 0.838059 ] [ 2.055265 2.344707 1.01543 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.63951e-11 9.225225000000001e-11 1.195567e-10 ] [ 1.348432e-10 3.073599e-11 2.755625000000001e-10 ] [ 2.422324e-11 2.903648e-10 2.041824e-10 ] [ 2.040932e-10 3.447440000000001e-12 8.38059e-11 ] [ 2.055265e-10 2.344707e-10 1.01543e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3713.929077 2305.7078292 -2110.0700939 ] [ 2820.0954506 -1640.7194819 -1464.2339866 ] [ -51.3171925 82.7147814 51.1186818 ] [ 833.1518474 -816.6864458 3559.2556583 ] [ 111.9989715 68.9833171 -36.0702595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.950370338478723e-06 3.69415117833976e-06 -3.380704972695841e-06 ] [ 4.518290999375761e-06 -2.628722395191268e-06 -2.3459614607113e-06 ] [ -8.22192060685931e-08 1.325236889536627e-07 8.190115686607446e-08 ] [ 1.334856411480609e-06 -1.308475929985006e-06 5.702556203178374e-06 ] [ 1.794421336909455e-07 1.105234578828529e-07 -5.77909264770891e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 380.5769 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.097514115965396e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.4803614 0.6205366 0.6888387 ] [ 1.3412159 0.3266464 3.3788023 ] [ 0.316189 2.9077564 2.3771131 ] [ 2.3816799 -0.1028763 0.64949 ] [ 2.692089 2.7606488 0.7522609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.803614e-11 6.205366e-11 6.888387000000001e-11 ] [ 1.3412159e-10 3.266464e-11 3.3788023e-10 ] [ 3.16189e-11 2.9077564e-10 2.3771131e-10 ] [ 2.3816799e-10 -1.028763e-11 6.4949e-11 ] [ 2.692089e-10 2.7606488e-10 7.522609e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.06e-05 7.2e-06 -1.83e-05 ] [ -1.8e-06 -1.34e-05 3.7e-06 ] [ 1.35e-05 2.2e-06 1.22e-05 ] [ -8.2e-06 1.4e-05 2.28e-05 ] [ -2.41e-05 -1e-05 -2.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.300483838848e-14 1.153567166976e-14 -2.931983216064e-14 ] [ -2.88391791744e-15 -2.146916671872e-14 5.928053496960001e-15 ] [ 2.16293843808e-14 3.52478856576e-15 1.954655477376e-14 ] [ -1.313784829056e-14 2.24304726912e-14 3.652962695424e-14 ] [ -3.861245656128e-14 -1.6021766208e-14 -3.28446207264e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }