Eötvös Quantum Utilities
v4.9.146
Providing the Horsepowers in the Quantum Realm
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Directories | |
directory | lib |
directory | source |
Files | |
file | Get_Atomic_Mass.m [code] |
Gives the molar mass of the element. | |
file | Read_Siesta_Lead.m [code] |
Creates the Hamiltonians and overlap integrals from the HSX file data of the Siesta package for the lead | |
file | Read_Siesta_Scatter.m [code] |
Creates the Hamiltonians and Overlap matrices from the HSX file data of the SIESTA output. | |
file | Read_Siesta_XML.m [code] |
Parses the SIESTA XML output and looks for relevant data | |
file | Siesta_Interface.m [code] |
Creates the Hamiltonians and overlap integrals from the loaded data from the Siesta package. | |