{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 11.9175141 -16.3107823 10.4933173 ] [ -13.7772956 1.9354779 -16.477588 ] [ -3.5435307 12.7166233 7.5135457 ] [ 6.3339833 -15.2147782 -1.9802009 ] [ -9.5450651 10.3426845 -6.0858025 ] [ 8.6143939 6.5307747 6.5367283 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.909396246907436e-08 -2.613275406801845e-08 1.681214765269618e-08 ] [ -2.207366090817071e-08 3.100977441455081e-09 -2.640000626077463e-08 ] [ -5.677362042627059e-09 2.037427654678055e-08 1.203802725985237e-08 ] [ 1.014815995979763e-08 -2.437676192269751e-08 -3.172631586467119e-09 ] [ -1.529288014723401e-08 1.657080730221054e-08 -9.750530484306192e-09 ] [ 1.380178050894213e-08 1.046345454005213e-08 1.047299325878173e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.303463220918061 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.451885098982759e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4883741 0.4588115 2.5545267 ] [ -0.1678433 1.4919436 1.2176363 ] [ 0.7508248 2.6229295 3.069551 ] [ 3.1071549 0.5663962 0.7663554 ] [ 1.666348 2.1572405 -0.20625 ] [ 2.8089357 2.6448921 1.8073025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4883741e-10 4.588115e-11 2.5545267e-10 ] [ -1.678433e-11 1.4919436e-10 1.2176363e-10 ] [ 7.508248e-11 2.6229295e-10 3.069551e-10 ] [ 3.1071549e-10 5.663962e-11 7.663554e-11 ] [ 1.666348e-10 2.1572405e-10 -2.0625e-11 ] [ 2.8089357e-10 2.6448921e-10 1.8073025e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.17e-05 -1.1e-06 3e-06 ] [ 1.98e-05 -7.3e-06 -2.12e-05 ] [ -9.4e-06 1.81e-05 -1e-05 ] [ -2.25e-05 1.29e-05 2e-07 ] [ -1.16e-05 6.3e-06 3.54e-05 ] [ 2.1e-06 -2.89e-05 -7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.476723267136e-14 -1.76239428288e-15 4.8065298624e-15 ] [ 3.172309709184e-14 -1.169588933184e-14 -3.396614436096001e-14 ] [ -1.506046023552e-14 2.899939683648e-14 -1.6021766208e-14 ] [ -3.604897396800001e-14 2.066807840832e-14 3.2043532416e-16 ] [ -1.858524880128e-14 1.009371271104e-14 5.671705237632e-14 ] [ 3.36457090368e-15 -4.630290434112001e-14 -1.185610699392e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.6065442790819375 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.058485078822507e-18 } }