| Introduction of n-electron valence states for multireference perturbation theory C Angeli, R Cimiraglia, S Evangelisti, T Leininger, JP Malrieu The Journal of Chemical Physics 114 (23), 10252-10264, 2001 | 1706 | 2001 |
| The D alton quantum chemistry program system K Aidas, C Angeli, KL Bak, V Bakken, R Bast, L Boman, O Christiansen, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (3), 269-284, 2014 | 1385 | 2014 |
| n-electron valence state perturbation theory: A spinless formulation and an efficient implementation of the strongly contracted and of the partially contracted variants C Angeli, R Cimiraglia, JP Malrieu The Journal of chemical physics 117 (20), 9138-9153, 2002 | 1082 | 2002 |
| N-electron valence state perturbation theory: a fast implementation of the strongly contracted variant C Angeli, R Cimiraglia, JP Malrieu Chemical physics letters 350 (3-4), 297-305, 2001 | 834 | 2001 |
| A quasidegenerate formulation of the second order -electron valence state perturbation theory approach C Angeli, S Borini, M Cestari, R Cimiraglia The Journal of chemical physics 121 (9), 4043-4049, 2004 | 348 | 2004 |
| New perspectives in multireference perturbation theory: the n-electron valence state approach C Angeli, M Pastore, R Cimiraglia Theoretical Chemistry Accounts 117, 743-754, 2007 | 289 | 2007 |
| Место установки программы:/opt/lib/dalton/Книги и статьи:• Aidas K., Angeli C., Bak KL The Dalton quantum chemistry program system.//Wires computational molecular science, 2014 … K Aidas science 4 (3), 269-284, 2014 | 211 | 2014 |
| Third-order multireference perturbation theory: The n-electron valence state perturbation-theory approach C Angeli, B Bories, A Cavallini, R Cimiraglia The Journal of chemical physics 124 (5), 2006 | 191 | 2006 |
| Ab initio evaluation of absorption and emission transitions for molecular solutes, including separate consideration of orientational and inductive solvent effects R Bonaccorsi, R Cimiraglia, J Tomasi Journal of computational chemistry 4 (4), 567-577, 1983 | 178 | 1983 |
| Recent advances in multireference second order perturbation CI: The CIPSI method revisited R Cimiraglia, M Persico Journal of computational chemistry 8 (1), 39-47, 1987 | 155 | 1987 |
| Second order perturbation correction to CI energies by use of diagrammatic techniques: An improvement to the CIPSI algorithm R Cimiraglia The Journal of chemical physics 83 (4), 1746-1749, 1985 | 137 | 1985 |
| Quasi-diabatic states and dynamical couplings from ab initio CI calculations: A new proposal R Cimiraglia, JP Malrieu, M Persico, F Spiegelmann Journal of Physics B: Atomic and Molecular Physics 18 (15), 3073, 1985 | 131 | 1985 |
| On the applicability of multireference second‐order perturbation theory to study weak magnetic coupling in molecular complexes N Queralt, D Taratiel, C de Graaf, R Caballol, R Cimiraglia, C Angeli Journal of computational chemistry 29 (6), 994-1003, 2008 | 95 | 2008 |
| Multireference perturbation configuration interaction V. Third-order energy contributions in the Møller–Plesset and Epstein–Nesbet partitions C Angeli, R Cimiraglia Theoretical Chemistry Accounts 107, 313-317, 2002 | 77 | 2002 |
| DALTON, a molecular electronic structure program H Agren, DJ Wilson, O Vahtras, PR Taylor, KO Sylvester-Hvid, ... see http://www. kjemi. uio. no/software/dalton/dalton. html: University of Oslo,, 2005 | 76 | 2005 |
| A novel perturbation-based complete active space–self-consistent-field algorithm: Application to the direct calculation of localized orbitals C Angeli, S Evangelisti, R Cimiraglia, D Maynau The Journal of chemical physics 117 (23), 10525-10533, 2002 | 74 | 2002 |
| On the free energy changes of a solution in light absorption or emission processes R Bonaccorsi, R Cimiraglia, J Tomasi Chemical Physics Letters 99 (1), 77-82, 1983 | 72 | 1983 |
| Merging multireference perturbation and density-functional theories by means of range separation: Potential curves for Be 2, Mg 2, and Ca 2 E Fromager, R Cimiraglia, HJA Jensen Physical Review A 81 (2), 024502, 2010 | 70 | 2010 |
| Rotation and inversion states in thermal E/Z isomerization of aromatic azo compounds R Cimiraglia, HJ Hofmann Chemical physics letters 217 (4), 430-435, 1994 | 70 | 1994 |
| Multireference perturbation CI I. Extrapolation procedures with CAS or selected zero-order spaces C Angeli, R Cimiraglia, M Persico, A Toniolo Theoretical Chemistry Accounts 98, 57-63, 1997 | 65 | 1997 |
