On the quality of basis sets
Author:
Publisher
Wiley
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics
Reference25 articles.
1. Quality of Gaussian basis sets: Direct optimization of orbital exponents by the method of conjugate gradients
2. Nonlinear programming approach to locally constrained variational calculations
3. Local behavior of the Clementi–Roetti atomic Hartree–Fock wave functions. Improved local accuracy using global constraints
4. Reduced local energy as a criterion for the accuracy of Hartree–Fock wave functions
5. Momentum space properties of various orbital basis sets used in quantum chemical calculations
Cited by 3 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. QUALITY: A program to assess basis set quality;Computer Physics Communications;1998-09
2. On the effect of basis set quality on the description of transition structures: the π attack of CH3+ to C2H2;Journal of Molecular Structure: THEOCHEM;1995-01
3. Application of orbital momentum properties to the analysis of the quality of basis sets;Journal of Molecular Structure: THEOCHEM;1993-11
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