{ "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" [ [ 2.841627 2.849258 1.50686 ] [ 0.998489 4.149663 3.105849 ] [ 4.765797 1.647113 1.498592 ] [ 3.299037 1.906995 3.475865 ] [ 3.256514 4.175642 3.223298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.841627e-10 2.849258e-10 1.50686e-10 ] [ 9.98489e-11 4.149663e-10 3.105849e-10 ] [ 4.765797e-10 1.647113e-10 1.498592e-10 ] [ 3.299037e-10 1.906995e-10 3.475865e-10 ] [ 3.256514e-10 4.175642e-10 3.223298000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8208179 0.2986562 -2.7832494 ] [ -0.6279559 -0.204133 -0.0956742 ] [ 0.8492639 -0.5140769 0.2614909 ] [ 0.3482838 -1.5813897 1.3375288 ] [ 1.251226 2.0009434 1.279904 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.917271870114152e-09 4.784999812969689e-10 -4.459257118535627e-09 ] [ -1.006096261873423e-09 -3.270571201337664e-10 -1.532869664537433e-10 ] [ 1.360670765469429e-09 -8.236419904733395e-10 4.189546065319508e-10 ] [ 5.58012161763383e-10 -2.533665605713926e-09 2.142957373006679e-09 ] [ 2.004685044537101e-09 3.205864735024063e-09 2.050632265668403e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3378897754089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.950065581767503e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6310726 3.3867962 0.9698619 ] [ 1.4362024 3.3379302 2.997323 ] [ 4.280578 1.9943097 1.9083948 ] [ 3.0856672 1.9453841 3.9358335 ] [ 3.7279438 4.0642508 2.9990508 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6310726e-10 3.3867962e-10 9.698619e-11 ] [ 1.4362024e-10 3.337930200000001e-10 2.997323e-10 ] [ 4.280578e-10 1.9943097e-10 1.9083948e-10 ] [ 3.0856672e-10 1.9453841e-10 3.9358335e-10 ] [ 3.7279438e-10 4.0642508e-10 2.9990508e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.93e-05 2e-06 1.58e-05 ] [ 4e-06 -1e-05 1.61e-05 ] [ -1.42e-05 -9.9e-06 -2.15e-05 ] [ 2.7e-06 3.28e-05 -7.2e-06 ] [ -3.18e-05 -1.49e-05 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.296554119743999e-14 3.2043532416e-15 2.531439060864e-14 ] [ 6.4087064832e-15 -1.6021766208e-14 2.579504359488e-14 ] [ -2.275090801536e-14 -1.586154854592e-14 -3.44467973472e-14 ] [ 4.32587687616e-15 5.255139316223999e-14 -1.153567166976e-14 ] [ -5.094921654144e-14 -2.387243164992e-14 -5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }