"set" nach Englisch mit Beispielen - Kollokationen-Wörterbuch Englisch
- The guided and radiation modes together form a complete basis set.
- It comes about when trying to relax the volume of a crystal using a constant basis set.
- Semiempirical calculations are usually carried out in a minimal basis set.
- The finite basis set is assumed to be approximately complete.
- The design of the laser determines which basis set of solutions is most useful.
- Another, more precise notation indicates exactly which and how many functions are added to the basis set, such as (d, p).
- These basis sets are popular in calculations involving periodic boundary conditions.
- Secondly the correlation energy is highly dependent on the basis set used.
- The largest basis set is 6-311+G(3df,2p) used at the MP2 level of theory.
- The 6-311G basis set is replaced by the smaller 6-31G basis.
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