How to get total energy from Hamiltonian？ |
- Date: 2024/10/15 17:53
- Name: LZQ
<220232383@seu.edu.cn>
- Dear Developers,
I know openmx can output total energy, but I want to get total energy from hamiltonian ?
I would appreciate it that if you give me some advice.
Best,
ZQ Li.
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