{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.4199865 -38.1306867 -7.3507214 ] [ -18.4588258 5.9260009 29.105232 ] [ -17.3459663 8.9515828 -24.6794309 ] [ -4.8611801 10.1746309 0.3699026 ] [ 19.9865502 7.1538033 -23.8380852 ] [ 29.0994085 5.9246688 26.3931029 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.349030551775162e-08 -6.10920947657895e-08 -1.177715397309425e-08 ] [ -2.957429914417986e-08 9.494500096819758e-09 4.663172225336002e-08 ] [ -2.779130167104468e-08 1.43420166813154e-08 -3.954080720262911e-08 ] [ -7.788469105718208e-09 1.630155575324926e-08 5.926492976931342e-10 ] [ 3.202198346088557e-08 1.146165639706189e-08 -3.819282279207849e-08 ] [ 4.662239197780879e-08 9.49236583734319e-09 4.228641241674868e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 19.987771 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.202393939810424e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.926819 -0.1887442 1.4325335 ] [ 0.800601 1.5673329 3.1471185 ] [ 0.8059782 1.5161251 -0.0891396 ] [ -0.0982962 2.8479748 1.5051671 ] [ 3.0114448 1.9276121 0.2269965 ] [ 2.9504897 0.9310183 2.2634515 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.26819e-11 -1.887442e-11 1.4325335e-10 ] [ 8.00601e-11 1.5673329e-10 3.1471185e-10 ] [ 8.059782e-11 1.5161251e-10 -8.91396e-12 ] [ -9.82962e-12 2.8479748e-10 1.5051671e-10 ] [ 3.0114448e-10 1.9276121e-10 2.269965e-11 ] [ 2.9504897e-10 9.310183e-11 2.2634515e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.81e-05 1.56e-05 -1.63e-05 ] [ -8e-06 -1.57e-05 3.2e-05 ] [ -2.6e-06 -1.7e-06 1.76e-05 ] [ 1.2e-05 1.26e-05 -3.55e-05 ] [ -2.89e-05 6e-07 -1.47e-05 ] [ 9.3e-06 -1.15e-05 1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.899939683648e-14 2.499395528448e-14 -2.611547891904e-14 ] [ -1.28174129664e-14 -2.515417294656e-14 5.12696518656e-14 ] [ -4.16565921408e-15 -2.72370025536e-15 2.819830852608e-14 ] [ 1.92261194496e-14 2.018742542208e-14 -5.68772700384e-14 ] [ -4.630290434112001e-14 9.6130597248e-16 -2.355199632576e-14 ] [ 1.490024257344e-14 -1.84250311392e-14 2.707678489152e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.421688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.829956148367191e-18 } }