{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4406098 -4.5078219 -6.793404 ] [ -3.0515428 5.1613369 -3.2922655 ] [ -5.2050521 2.2327896 9.6994565 ] [ 0.5326632 -9.2386798 3.3966072 ] [ 13.1645415 6.3523751 -3.0103943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.716817824455364e-09 -7.222326858910235e-09 -1.08842330644492e-08 ] [ -4.889110531530571e-09 8.269373313252348e-09 -5.274790813566423e-09 ] [ -8.339412784665945e-09 3.577323296285384e-09 1.55402424387666e-08 ] [ 8.534205258005147e-10 -1.480199678261722e-08 5.44196464588095e-09 ] [ 2.109192061485137e-08 1.017762687177206e-08 -4.823183366849582e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8935756 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.442549039237333e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2353247 2.8509183 0.7932398 ] [ 1.7797209 5.4289203 1.214234 ] [ 2.4195315 4.1766596 4.6120973 ] [ 2.6774445 1.9856114 3.1411352 ] [ 3.7631353 4.1483764 2.3587517 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2353247e-10 2.8509183e-10 7.932398000000001e-11 ] [ 1.7797209e-10 5.4289203e-10 1.214234e-10 ] [ 2.4195315e-10 4.1766596e-10 4.6120973e-10 ] [ 2.6774445e-10 1.9856114e-10 3.1411352e-10 ] [ 3.7631353e-10 4.1483764e-10 2.3587517e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.7e-06 5e-07 -1.32e-05 ] [ -1.01e-05 5e-06 1.48e-05 ] [ -1.7e-05 -3.6e-06 6.4e-06 ] [ -7.3e-06 6e-07 2.34e-05 ] [ 2.77e-05 -2.5e-06 -3.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073458335936e-14 8.010883104e-16 -2.114873139456e-14 ] [ -1.618198387008e-14 8.010883104e-15 2.371221398784e-14 ] [ -2.72370025536e-14 -5.76783583488e-15 1.025393037312e-14 ] [ -1.169588933184e-14 9.6130597248e-16 3.749093292672001e-14 ] [ 4.438029239616e-14 -4.005441552e-15 -5.014812823104e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.498488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.842260864814935e-18 } }