| 1 |
The Kohn-Sham electronic density of states of liquid HCN: Tuning a long-range corrected exchange-correlation functional for predicting electron binding energies
Cabral BJC
Chemical Physics Letters, 724, 96, 2019 |
| 2 |
Electron binding energies and the fundamental gap of a push-pull dye in a polar environment: p-nitroaniline in liquid water
Cabral BJC
Chemical Physics Letters, 667, 332, 2017 |
| 3 |
Optimization of the spin-component-scaled factor for electron propagator method
Lim FH, Nishida M, Hori Y, Ida T, Mizuno M
Chemical Physics Letters, 678, 159, 2017 |
| 4 |
First experimental photoelectron spectra of superhalogens and their theoretical interpretations
Wang XB, Ding CF, Wang LS, Boldyrev AI, Simons J
Journal of Chemical Physics, 110(10), 4763, 1999 |
| 5 |
Partial 3rd-Order Quasi-Particle Theory - Comparisons for Closed-Shell Ionization Energies and an Application to the Borazine Photoelectron-Spectrum
Ortiz JV
Journal of Chemical Physics, 104(19), 7599, 1996 |
| 6 |
Perturbative Treatment of the Similarity Transformed Hamiltonian in Equation-of-Motion Coupled-Cluster Approximations
Stanton JF, Gauss J
Journal of Chemical Physics, 103(3), 1064, 1995 |
| 7 |
Analytic Energy Derivatives for Ionized States Described by the Equation-of-Motion Coupled-Cluster Method
Stanton JF, Gauss J
Journal of Chemical Physics, 101(10), 8938, 1994 |
| 8 |
Conformationally Induced Localization in the Electronic-Structure of Polysilanes
Ortiz JV, Rohlfing CM
Macromolecules, 26(26), 7282, 1993 |
