{ "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" [ [ 2.371302 1.822431 2.77878 ] [ 1.953583 1.464236 4.887458 ] [ 2.036561 3.993513 4.302634 ] [ 4.621904 2.219697 2.273588 ] [ 4.551448 2.283743 4.505208 ] [ 4.054448 4.223119 3.103646 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.371302e-10 1.822431e-10 2.77878e-10 ] [ 1.953583e-10 1.464236e-10 4.887458e-10 ] [ 2.036561e-10 3.993513e-10 4.302634e-10 ] [ 4.621904e-10 2.219697e-10 2.273588e-10 ] [ 4.551448e-10 2.283743e-10 4.505208e-10 ] [ 4.054448e-10 4.223119e-10 3.103646e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1948143 -0.4334288 -2.127503 ] [ 1.0098195 0.906376 1.1102871 ] [ 0.4431748 -0.9418198 -0.2419051 ] [ 0.4876122 -1.4680052 -2.3630369 ] [ -0.2127374 -0.9587048 3.2643471 ] [ -0.5330549 2.8955826 0.3578108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.914303537657518e-09 -6.944294901413991e-10 -3.408635567281862e-09 ] [ 1.617909194127946e-09 1.452174436854221e-09 1.778876033995832e-09 ] [ 7.100443034877158e-10 -1.508961664566532e-09 -3.875746956722861e-10 ] [ 7.812408668568538e-10 -2.352003610652828e-09 -3.786002475267707e-09 ] [ -3.408428886497779e-10 -1.53601441680874e-09 5.23006060579628e-09 ] [ -8.540480983828819e-10 4.639234745315278e-09 5.732760984297446e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.035322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.60783582905999e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1214216 1.7862014 2.5425312 ] [ 2.4290407 1.7515711 4.966748 ] [ 1.9018284 3.8507199 3.8317716 ] [ 4.3496397 2.1961343 2.2655975 ] [ 4.657264 2.1614731 4.6898097 ] [ 4.1300516 4.2606392 3.554856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1214216e-10 1.7862014e-10 2.5425312e-10 ] [ 2.4290407e-10 1.7515711e-10 4.966748e-10 ] [ 1.9018284e-10 3.8507199e-10 3.8317716e-10 ] [ 4.3496397e-10 2.1961343e-10 2.2655975e-10 ] [ 4.657264e-10 2.1614731e-10 4.689809699999999e-10 ] [ 4.1300516e-10 4.2606392e-10 3.554856e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 -5.1e-06 3.6e-06 ] [ 1.5e-05 -3.31e-05 -1.09e-05 ] [ -1.7e-06 4.11e-05 -5.3e-06 ] [ -4.5e-06 -2.36e-05 5.8e-06 ] [ 5.5e-06 -2e-05 1.49e-05 ] [ -1.49e-05 4.07e-05 -8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-16 -8.17110076608e-15 5.76783583488e-15 ] [ 2.4032649312e-14 -5.303204614848e-14 -1.746372516672e-14 ] [ -2.72370025536e-15 6.584945911488e-14 -8.491536090240001e-15 ] [ -7.2097947936e-15 -3.781136825088e-14 9.292624400640001e-15 ] [ 8.8119714144e-15 -3.2043532416e-14 2.387243164992e-14 ] [ -2.387243164992e-14 6.520858846656e-14 -1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }