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Keyword [basis set]
Result: 1 - 12 | Page: 1 of 1
1. Application Of B-spline Basis Set Methods For The Spectral Calculation Of Atoms In Strong External Fields
2. The Study Of Molecular Nonlinear Optical Properties
3. Influence Of Basis Sets On The Energy-level Calculations Of Fullerene Molecules
4. Implementation Of Nonlocal Exchange And Correlation Interaction In Extended Systems With Numerical Atomic Basis Set
5. Full-Relativistic Study On Electron Structure Of O~+Ion And Z=119Atom
6. The Influence Of Nuclear Distance And Power Exponent On Gauss Function Dual-center Overlap Integral
7. Atomic Structure And Photoionization Cross Section Calculations And Study Of Absorption Spectroscopy Of Cold Atoms In A MOT
8. The Relativistic Calculations On The Polarization Properties Of Alkaline-earth Metal Ions
9. B-spline Basis Set Method To Calculate The Helium Atom Lamb Shift
10. The Construction Of Global Potential Energy Surface And Dynamics For Small Sulfur Containing Molecular System
11. SYSTEMATIC STUDIES OF MOLECULAR VIBRATIONAL ANHARMONICITY AND VIBRATION-ROTATION INTERACTION BY SELF-CONSISTENT-FIELD HIGHER DERIVATIVE METHODS: APPLICATIONS TO ASYMMETRIC AND SYMMETRIC TOP AND LINEAR POLYATOMIC MOLECULE
12. Introduction of a fully relativistic capable basis set in the ab initio orthogonalized linear combination of atomic orbitals method
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