{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2727509 -1.7095402 0.7862234 ] [ -1.8132363 0.9334386 -1.5012332 ] [ -0.887587 2.1976176 1.977603 ] [ 4.4314905 -8.532588 -8.2110581 ] [ 0.586805 -1.3514426 14.2401158 ] [ -1.0447214 8.4625146 -7.2916508 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.039171736082159e-09 -2.738985340757756e-09 1.259668750205887e-09 ] [ -2.905124807845895e-09 1.495533501872283e-09 -2.40524073540877e-09 ] [ -1.42207114032601e-09 3.520971540178606e-09 3.168469291823943e-09 ] [ 7.100030474397302e-09 -1.367071300851863e-08 -1.315556531985047e-08 ] [ 9.40165251968544e-10 -2.165249738073166e-09 2.281518061224469e-08 ] [ -1.673828202329445e-09 1.355844304529866e-08 -1.168251243879762e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5867078 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.3757422486801e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5181424 0.1198939 1.6744975 ] [ -0.0930999 2.2949788 0.8537838 ] [ 1.5227334 3.3616966 2.4774229 ] [ 2.9138119 0.5330304 0.9851934 ] [ 2.1339879 1.1866009 3.2981334 ] [ 2.3025696 2.7081172 0.1644853 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.181424e-11 1.198939e-11 1.6744975e-10 ] [ -9.30999e-12 2.2949788e-10 8.537838e-11 ] [ 1.5227334e-10 3.3616966e-10 2.4774229e-10 ] [ 2.9138119e-10 5.330304e-11 9.851934e-11 ] [ 2.1339879e-10 1.1866009e-10 3.2981334e-10 ] [ 2.3025696e-10 2.7081172e-10 1.644853e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.38e-05 -5.8e-06 -3.4e-06 ] [ 2.28e-05 1.08e-05 -3e-06 ] [ 1.06e-05 -4.36e-05 2.78e-05 ] [ -9.1e-06 -2.36e-05 -7.1e-06 ] [ -2.59e-05 5.29e-05 -6e-07 ] [ -2.21e-05 9.2e-06 -1.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.813180357504e-14 -9.292624400640001e-15 -5.44740051072e-15 ] [ 3.652962695424e-14 1.730350750464e-14 -4.8065298624e-15 ] [ 1.698307218048e-14 -6.985490066688e-14 4.454051005824e-14 ] [ -1.457980724928e-14 -3.781136825088e-14 -1.137545400768e-14 ] [ -4.149637447872e-14 8.475514324032001e-14 -9.6130597248e-16 ] [ -3.540810331968e-14 1.474002491136e-14 -2.178960204288e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.807034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.532566031899071e-18 } }