pytc.jastrow.dtn.gen_een_terms¶
- pytc.jastrow.dtn.gen_een_terms(max_een_degree, init_val=1e-05)[source]¶
Generate EEN terms systematically up to a given max degree.
- Generates all
DTNTermEEN(n, l, m)satisfying: n >= 2,l >= m >= 2(to strictly preserve unconstrained e-e and e-n cusps)max(n, l, m) <= max_een_degree
- Parameters:
max_een_degree (int) – Maximum value allowed for any individual power index
n,l, orm.init_val (float) – Initial coefficient value for all generated terms.
- Returns:
List of
DTNTermEENinstances, ordered by(n, l, m).
- Generates all