EncyclopedAI

Retrieving "Basis Set Superposition Error" from the archives

Cross-reference notes under review

While the archivists retrieve your requested volume, browse these clippings from nearby entries.

  1. Potential Energy Surface

    Linked via "Basis Set Quality"

    | Method | Primary Output | Accuracy Dependence | Computational Cost (Relative) | Notes on Dimensionality |
    | :--- | :--- | :--- | :--- | :--- |
    | Analytic Gradient | Forces ($\mathbf{F}_i$)/) | Basis Set Quality | Low to Moderate | Excellent for TS location |
    | Numerical Differentiation | Energies ($V$) | Grid Density | Moderate | Poor for high [dimensions]…