{ "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" [ [ 1.417514882130389e-09 -2.736898047604911e-09 1.291695951062369e-09 ] [ -4.30702826500697e-09 -4.523144268990596e-09 -2.445596860935231e-09 ] [ -7.148342727332275e-09 4.021246096188429e-09 4.571401989424339e-09 ] [ -5.845511007792953e-10 1.871193946955692e-09 7.392106532182858e-10 ] [ 1.222836001509683e-09 2.418646006904063e-09 -1.617182620354044e-09 ] [ 7.596068264003298e-09 -3.968177039322784e-09 3.217047473688845e-09 ] [ 1.803503105692835e-09 2.917133305870107e-09 -5.756576586104565e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.484735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.121798713668199e-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" [ [ 2.2430472876e-15 -6.600967732079998e-14 -6.8893595262e-15 ] [ 2.78778734316e-14 4.726421070299999e-14 -5.1269652288e-15 ] [ 5.431378789259999e-14 -2.851874408519999e-14 -1.26571954086e-14 ] [ 3.6048974265e-14 -2.4833737827e-14 2.2430472876e-15 ] [ -5.799879415079998e-14 7.209794852999999e-14 3.81318038892e-14 ] [ -9.468863906939999e-14 -2.38724318466e-14 -7.690447843199998e-15 ] [ 3.204353268e-14 2.38724318466e-14 -8.1711008334e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.152427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.549210092579071e-18 } }