{ "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" [ [ 2.673592 1.767732 1.794498 ] [ 2.791934 4.53061 0.3856556 ] [ 2.184868 4.104179 2.619474 ] [ 3.820974 5.464835 2.237655 ] [ 4.399704 3.304978 2.526424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.673592000000001e-10 1.767732e-10 1.794498e-10 ] [ 2.791934e-10 4.53061e-10 3.856556e-11 ] [ 2.184868e-10 4.104179e-10 2.619474e-10 ] [ 3.820974e-10 5.464835e-10 2.237655e-10 ] [ 4.399704e-10 3.304978e-10 2.526424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5014359 1.0555267 0.3679906 ] [ -0.3094677 0.1490215 -0.2531216 ] [ -2.5497206 -1.9365528 0.2717271 ] [ 1.7824804 2.7051609 -0.6455008 ] [ 0.5752721 -1.9731563 0.2589048 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.033888758098068e-10 1.691140201370175e-09 5.895859359941645e-10 ] [ -4.958219138327482e-10 2.387587632965472e-10 -4.055455097394893e-10 ] [ -4.085102734892149e-09 -3.102699621104779e-09 4.353548068577837e-10 ] [ 2.855848423914232e-09 4.334145549482287e-09 -1.034206290467697e-09 ] [ 9.216875092185196e-10 -3.161344893044231e-09 4.148112175728998e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.204632399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.736563729112448e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8699824 2.2391686 1.4163399 ] [ 2.5127156 4.3493179 0.4358218 ] [ 2.1479072 4.0517701 2.7543547 ] [ 3.9915957 5.3211153 1.9883392 ] [ 4.3488711 3.2109621 2.9688511 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8699824e-10 2.2391686e-10 1.4163399e-10 ] [ 2.5127156e-10 4.3493179e-10 4.358218e-11 ] [ 2.1479072e-10 4.0517701e-10 2.7543547e-10 ] [ 3.9915957e-10 5.3211153e-10 1.9883392e-10 ] [ 4.3488711e-10 3.2109621e-10 2.9688511e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 -9.1e-06 -3.8e-06 ] [ -9.9e-06 6.9e-06 3.9e-06 ] [ 6.9e-06 3.6e-06 -8.9e-06 ] [ 3e-06 -1.52e-05 4.8e-06 ] [ -2.8e-06 1.38e-05 4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 -1.457980724928e-14 -6.08827115904e-15 ] [ -1.586154854592e-14 1.105501868352e-14 6.24848882112e-15 ] [ 1.105501868352e-14 5.76783583488e-15 -1.425937192512e-14 ] [ 4.8065298624e-15 -2.435308463616e-14 7.69044777984e-15 ] [ -4.48609453824e-15 2.211003736704e-14 6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }