{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8847432 -1.7082374 0.8062132 ] [ -2.6882356 -2.8231246 -1.5264215 ] [ -4.4616446 2.5098644 2.8532447 ] [ -0.3648481 1.1679074 0.461379 ] [ 0.7632342 1.5096001 -1.009366 ] [ 4.7410929 -2.4767413 2.0079231 ] [ 1.1256581 1.8207314 -3.5929725 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.417514870451778e-09 -2.736898025056178e-09 1.291695940420355e-09 ] [ -4.307028229522261e-09 -4.523144231725352e-09 -2.445596840786468e-09 ] [ -7.148342668438567e-09 4.02124606305822e-09 4.571401951761509e-09 ] [ -5.845510959633005e-10 1.871193931539314e-09 7.392106471280833e-10 ] [ 1.222835991434991e-09 2.418645986977342e-09 -1.617182607030413e-09 ] [ 7.596068201420872e-09 -3.968177006629799e-09 3.217047447184261e-09 ] [ 1.803503090834149e-09 2.917133281836453e-09 -5.756576538677328e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.484735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.121798687948349e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6321929 1.3195925 1.9818227 ] [ 2.4608951 0.367892 4.0439157 ] [ 2.4007996 2.660682 5.0239798 ] [ 1.5761643 3.4569761 2.8954618 ] [ 4.0383336 1.2033856 2.18602 ] [ 4.5678687 1.551248 4.5785164 ] [ 3.9782309 3.4961825 3.1660756 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6321929e-10 1.3195925e-10 1.9818227e-10 ] [ 2.4608951e-10 3.67892e-11 4.043915700000001e-10 ] [ 2.4007996e-10 2.660682e-10 5.0239798e-10 ] [ 1.5761643e-10 3.4569761e-10 2.8954618e-10 ] [ 4.0383336e-10 1.2033856e-10 2.18602e-10 ] [ 4.5678687e-10 1.551248e-10 4.5785164e-10 ] [ 3.9782309e-10 3.4961825e-10 3.1660756e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 -4.12e-05 -4.3e-06 ] [ 1.74e-05 2.95e-05 -3.2e-06 ] [ 3.39e-05 -1.78e-05 -7.9e-06 ] [ 2.25e-05 -1.55e-05 1.4e-06 ] [ -3.62e-05 4.5e-05 2.38e-05 ] [ -5.91e-05 -1.49e-05 -4.8e-06 ] [ 2e-05 1.49e-05 -5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.24304726912e-15 -6.600967677696001e-14 -6.889359469440001e-15 ] [ 2.787787320192e-14 4.72642103136e-14 -5.126965186560001e-15 ] [ 5.431378744512e-14 -2.851874385024e-14 -1.265719530432e-14 ] [ 3.604897396800001e-14 -2.48337376224e-14 2.24304726912e-15 ] [ -5.799879367296e-14 7.209794793600001e-14 3.813180357504e-14 ] [ -9.468863828927999e-14 -2.387243164992e-14 -7.69044777984e-15 ] [ 3.2043532416e-14 2.387243164992e-14 -8.17110076608e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.152427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.549210063337869e-18 } }