Open superstar54 opened 5 months ago
When showing the index of the atoms, in Python, the index starts from 0, while in code (like QuantumESPRESSO) written in Fortron, it starts at 1. It is good to have an option to allow the user to select the scheme.
When showing the index of the atoms, in Python, the index starts from 0, while in code (like QuantumESPRESSO) written in Fortron, it starts at 1. It is good to have an option to allow the user to select the scheme.