Basis Set (chemistry) - Minimal Basis Sets

Minimal Basis Sets

The most common minimal basis set is STO-nG, where n is an integer. This n value represents the number of Gaussian primitive functions comprising a single basis function. In these basis sets, the same number of Gaussian primitives comprise core and valence orbitals. Minimal basis sets typically give rough results that are insufficient for research-quality publication, but are much cheaper than their larger counterparts. Commonly used minimal basis sets of this type are:

  • STO-3G
  • STO-4G
  • STO-6G
  • STO-3G* - Polarized version of STO-3G

There are several other minimum basis sets that have been used such as the MidiX basis sets.

Read more about this topic:  Basis Set (chemistry)

Famous quotes containing the words minimal, basis and/or sets:

    For those parents from lower-class and minority communities ... [who] have had minimal experience in negotiating dominant, external institutions or have had negative and hostile contact with social service agencies, their initial approaches to the school are often overwhelming and difficult. Not only does the school feel like an alien environment with incomprehensible norms and structures, but the families often do not feel entitled to make demands or force disagreements.
    Sara Lawrence Lightfoot (20th century)

    Brutus. How many times shall Caesar bleed in sport,
    That now on Pompey’s basis lies along,
    No worthier than the dust!
    Cassius. So oft as that shall be,
    So often shall the knot of us be called
    The men that gave their country liberty.
    William Shakespeare (1564–1616)

    This is certainly not the place for a discourse about what festivals are for. Discussions on this theme were plentiful during that phase of preparation and on the whole were fruitless. My experience is that discussion is fruitless. What sets forth and demonstrates is the sight of events in action, is living through these events and understanding them.
    Doris Lessing (b. 1919)