{ "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" [ [ 0.223645 0.1945873 1.126976 ] [ 0.7288277 2.388611 0.0814776 ] [ 2.404153 0.5300895 0.5572584 ] [ 2.145602 0.6403931 2.690423 ] [ 2.26761 2.998114 1.480003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.23645e-11 1.945873e-11 1.126976e-10 ] [ 7.288277e-11 2.388611e-10 8.14776e-12 ] [ 2.404153e-10 5.300895e-11 5.572584000000001e-11 ] [ 2.145602e-10 6.403931000000001e-11 2.690423e-10 ] [ 2.26761e-10 2.998114e-10 1.480003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0151055 0.5417044 0.1878952 ] [ -1.040402 -1.1331297 -0.7802588 ] [ 0.483037 0.6359925 -1.8254547 ] [ -0.4848814 0.784464 1.144292 ] [ 1.0573519 -0.8290312 1.2735263 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4201679144887e-11 8.679061322149894e-10 3.010412990807567e-10 ] [ -1.666907774366868e-09 -1.81547392863143e-09 -1.250112417832879e-09 ] [ 7.739105947574579e-10 1.018972322899245e-09 -2.924700866765479e-09 ] [ -7.768656493412076e-10 1.256849891014176e-09 1.833357904873128e-09 ] [ 1.694064508095504e-09 -1.328254417496981e-09 2.040414080644474e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.713791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.036973886975949e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2517321 0.2110045 1.2033468 ] [ 0.6533017 2.263378 0.025592 ] [ 2.4453453 0.7201962 0.3930191 ] [ 2.0089452 0.7524211 2.7459663 ] [ 2.4105134 2.8047951 1.5682138 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.517321e-11 2.110045e-11 1.2033468e-10 ] [ 6.533017e-11 2.263378e-10 2.5592e-12 ] [ 2.4453453e-10 7.201962e-11 3.930191e-11 ] [ 2.0089452e-10 7.524210999999999e-11 2.7459663e-10 ] [ 2.4105134e-10 2.8047951e-10 1.5682138e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.9e-06 7.8e-06 4.2e-06 ] [ -3.7e-06 7.9e-06 2.6e-06 ] [ 1.09e-05 -7.5e-06 -3.6e-06 ] [ -4.3e-06 -2.9e-06 2.3e-06 ] [ -9.8e-06 -5.3e-06 -5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.10550187746e-14 1.24969777452e-14 6.729141862799999e-15 ] [ -5.9280535458e-15 1.26571954086e-14 4.165659248399999e-15 ] [ 1.74637253106e-14 -1.2016324755e-14 -5.767835882399999e-15 ] [ -6.8893595262e-15 -4.6463122386e-15 3.685006258199999e-15 ] [ -1.57013310132e-14 -8.4915361602e-15 -8.811971486999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }