State of The Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More

2. Hypergeometric orthogonal polynomials as expansion basis sets for atomic and molecular orbitals: The Jacobi ladder

3. Two-dimensional Sturmian basis set for bound state calculations

4. Normalizing cluster wavefunctions in the interstitial region within the muffin-tin approximation

5. Self-consistent electron–nucleus cusp correction for molecular orbitals

6. Configuration interaction study of the ³P ground and low-lying states of the boron anion: The boron electron affinity

7. Advances in approximate natural orbital functional theory

8. Collision processes in atoms and molecules using effective potentials

9. Unified construction of Fermi, Pauli, and exchange-correlation potentials

10. Potential energy curves of the NaH molecule and its cation with the Fock space coupled cluster method

11. An analysis of the performance of coupled cluster methods for K-edge core excitations and ionizations using standard basis sets

12. Determination of electronic couplings in the singlet fission process using a nonorthogonal configuration interaction approach

13. Diagnosis of two evaluation paths to density-based descriptors of molecular electronic transitions

14. Physisorption energy of H and H2 on clean Pt(111) as a useful surface energy reference in Quantum Monte Carlo calculation

15. Stability after confinement of the H atom