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solve_hf3c_batch

sci_form::hf::api

Function solve_hf3c_batch 

Source 
pub fn solve_hf3c_batch(
    molecules: &[(&[u8], &[[f64; 3]])],
    config: &HfConfig,
) -> Vec<Result<Hf3cResult, String>>
Expand description

Batch-process multiple HF-3c calculations in parallel.