{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3093337 -1.5993401 -6.7881427 ] [ -3.6750017 -4.5523505 5.305104 ] [ 7.0893495 -6.0601628 -1.3103721 ] [ 1.1874252 5.0030963 10.0183013 ] [ 2.8617228 0.7997478 0.1359769 ] [ -0.4370676 6.550823 -7.1791886 ] [ 0.2829055 -0.1418137 -0.1816789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.171084356776556e-08 -2.562425316927934e-09 -1.087580353259419e-08 ] [ -5.888001805140256e-09 -7.29366954078719e-09 8.499713599712563e-09 ] [ 1.135839002558017e-08 -9.709451156401865e-09 -2.0994475431686e-09 ] [ 1.902464894388764e-09 8.015843923470984e-09 1.605108812299025e-08 ] [ 4.584985365370314e-09 1.281337227696234e-09 2.178590101488595e-10 ] [ -7.002594904291661e-10 1.049557545759892e-08 -1.150232813123388e-08 ] [ 4.532645779957344e-10 -2.27210594649145e-10 -2.910816860726611e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.914917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.069197807697248e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1091435 1.898023 1.4020338 ] [ 2.4658717 1.3819216 3.8636255 ] [ 4.1889587 0.7321598 2.1669517 ] [ 3.8637636 3.2032999 4.5211053 ] [ 5.2241794 2.8798067 2.4672572 ] [ 3.3770096 3.9076047 1.1613889 ] [ 2.8824054 4.9222418 3.2346886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1091435e-10 1.898023e-10 1.4020338e-10 ] [ 2.4658717e-10 1.3819216e-10 3.8636255e-10 ] [ 4.1889587e-10 7.321598e-11 2.1669517e-10 ] [ 3.8637636e-10 3.2032999e-10 4.5211053e-10 ] [ 5.2241794e-10 2.8798067e-10 2.4672572e-10 ] [ 3.3770096e-10 3.9076047e-10 1.1613889e-10 ] [ 2.8824054e-10 4.9222418e-10 3.2346886e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.77e-05 -1.38e-05 9.7e-06 ] [ -4.2e-06 4.15e-05 -3.34e-05 ] [ -2.7e-06 -3e-06 1.34e-05 ] [ 1.41e-05 -2.5e-05 -3e-07 ] [ -5.2e-05 5e-06 -2.53e-05 ] [ -6.4e-06 -1.24e-05 4.01e-05 ] [ 3.5e-06 7.7e-06 -4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.642382481215999e-14 -2.211003736704e-14 1.554111322176e-14 ] [ -6.72914180736e-15 6.64903297632e-14 -5.351269913472e-14 ] [ -4.32587687616e-15 -4.8065298624e-15 2.146916671872e-14 ] [ 2.259069035328e-14 -4.005441552e-14 -4.8065298624e-16 ] [ -8.33131842816e-14 8.010883104e-15 -4.053506850624e-14 ] [ -1.025393037312e-14 -1.986699009792e-14 6.424728249408e-14 ] [ 5.6076181728e-15 1.233675998016e-14 -6.889359469440001e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.439394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.11453425893198e-18 } }