.. highlight:: none .. _subsec:energy_uhfk.dat: energy ~~~~~~~~~~ The values of the energy, the number of electrons, and the spin obtained by the wave-number space UHF method are outputted. The filename is specified by the keyword ``energy`` in ``file.output`` section in the parameter file. An example of the file is shown as follows. :: Energy_Total = -5.88984624257707 Energy_Band = -0.9265413257740396 Energy_Coulomb = -4.963304916803031 NCond = 8.000000000000007 Sz = 3.2822430107160017e-07 File format ^^^^^^^^^^^^ - ``Energy_Total = [energy_total]`` - ``Energy_Band = [energy_band]`` - ``Energy_``\{type} ``= [energy_``\type ``]`` - ``NCond = [ncond]`` - ``Sz = [sz]`` Parameters ^^^^^^^^^^ - ``[energy_total]`` **Type :** Float **Description :** The value of the energy calculated from the eigenvectors obtained by the UHF mothod. - ``[energy_band]`` **Type :** Float **Description :** The value of the energy derived only from the eigenvalues of the Hamiltonian obtained by the UHF method. - ``[energy_``\type ``]`` **Type :** Float **Description :** The value of the energy calculated separately for each interaction type. - ``[ncond]`` **Type :** Float **Description :** The expectation value of the total number of electrons denoted by :math:`\sum_{i}\langle n_{i}\rangle`. - ``[sz]`` **Type :** Float **Description :** The expectation value of the :math:`z` component of total spin :math:`S_z` denoted by :math:`\sum_{i}\langle (n_{i\uparrow}-n_{i\downarrow})\rangle/2`. .. raw:: latex