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

<p>1. Computing accurate molecular properties in real space using multiresolution analysis</p> <p>Florian A. Bischoff</p> <p>2. Hypergeometric orthogonal polynomials as expansion basis sets for atomic and molecular orbitals: The Jacobi ladder</p> <p>Cecilia Coletti, Vincenzo Aquilanti and Federico Palazzetti</p> <p>3. Two-dimensional Sturmian basis set for bound state calculations</p> <p>Juan Martin Randazzo and Lorenzo Ugo Ancarani</p> <p>4. Normalizing cluster wavefunctions in the interstitial region within the muffin-tin approximation</p> <p>Daniel Gebremedhin, Charles Weatherford and Brian Wilson</p> <p>5. Self-consistent electron–nucleus cusp correction for molecular orbitals</p> <p>Pierre-Francois Loos, Anthony Scemama and Michel Caffarel</p> <p>6. Configuration interaction study of the <SUP>3</SUP>P ground and low-lying states of the boron anion: The boron electron affinity</p> <p>María Belén Ruiz</p> <p>7. Advances in approximate natural orbital functional theory</p> <p>Ion Mitxelena, Mario Piris and Jesus M. Ugalde</p> <p>8. Collision processes in atoms and molecules using effective potentials</p> <p>Alejandra M.P. Mendez, Dario M. Mitnik and Jorge E. Miraglia</p> <p>9. Unified construction of Fermi, Pauli, and exchange-correlation potentials</p> <p>Viktor N. Staroverov and Egor Ospadov</p> <p>10. Potential energy curves of the NaH molecule and its cation with the Fock space coupled cluster method</p> <p>Artur Lison, Monika Musial and Stanislaw A. Kucharski</p> <p>11. An analysis of the performance of coupled cluster methods for K-edge core excitations and ionizations using standard basis sets</p> <p>Johanna P. Carbone, Lan Cheng, Rolf H. Myhre, Devin Matthews, Henrik Koch and Sonia Coriani</p> <p>12. Determination of electronic couplings in the singlet fission process using a nonorthogonal configuration interaction approach</p> <p>Luis Enrique Aguilar Suarez, R. K. Kathir, Enrico Siagri, Remco W. A. Havenith and Shirin Faraji</p> <p>13. Diagnosis of two evaluation paths to density-based descriptors of molecular electronic transitions</p> <p>Gabriel Breuil, Kaltrina Shehu, Elise Lognon, Sylvain Pitie, Benjamin Lasorne</p> <p>and Thibaud Etienne</p> <p>14. Physisorption energy of H and H2 on clean Pt(111) as a useful surface energy reference in Quantum Monte Carlo calculation</p> <p>Rajesh O. Sharma and Philip E. Hoggan</p> <p>15. Stability after confinement of the H atom</p> <p>Milagros F. Morcillo, Enrique F. Borja, Jose M. Alcaraz-Pelegrina and</p> <p>Antonio Sarsa</p>