| 2009 |
|---|
| 11 | EE | Wissam Helal,
Stefano Evangelisti,
Thierry Leininger,
Daniel Maynau:
Ab-initio multireference study of an organic mixed-valence Spiro molecular system.
Journal of Computational Chemistry 30(1): 83-92 (2009) |
| 2008 |
|---|
| 10 | EE | Anthony Scemama,
Antonio Monari,
Celestino Angeli,
Stefano Borini,
Stefano Evangelisti,
Elda Rossi:
Common Format for Quantum Chemistry Interoperability: Q5Cost Format and Library.
ICCSA (1) 2008: 1094-1107 |
| 2006 |
|---|
| 9 | EE | Wissam Helal,
Benoît Bories,
Stefano Evangelisti,
Thierry Leininger,
Daniel Maynau:
Ab-Initio Multi-reference Study of a Bistable Spiro Molecule.
ICCSA (1) 2006: 744-751 |
| 2005 |
|---|
| 8 | EE | Stefano Borini,
Daniel Maynau,
Stefano Evangelisti:
A combined freeze-and-cut strategy for the description of large molecular systems using a localized orbitals approach.
Journal of Computational Chemistry 26(10): 1042-1051 (2005) |
| 7 | EE | J. M. Junquera-Hernández,
José-Vicente Pitarch Ruiz,
José Sánchez-Marín,
Stefano Evangelisti,
Daniel Maynau:
Multistate active spaces from local CAS-SCF molecular orbitals: The photodissociation of HFCO as an example.
Journal of Computational Chemistry 26(12): 1254-1262 (2005) |
| 2004 |
|---|
| 6 | EE | José-Vicente Pitarch Ruiz,
Stefano Evangelisti,
Daniel Maynau:
Local orbitals for excited states.
Future Generation Comp. Syst. 20(5): 821-828 (2004) |
| 2003 |
|---|
| 5 | EE | Elda Rossi,
Andrew Emerson,
Stefano Evangelisti:
Common Data Format for Program Sharing and Integration.
International Conference on Computational Science 2003: 316-323 |
| 1998 |
|---|
| 4 | EE | Elda Rossi,
Gian Luigi Bendazzoli,
Stefano Evangelisti:
Full configuration interaction algorithm on a massively parallel architecture: Direct-list implementation.
Journal of Computational Chemistry 19(6): 658-672 (1998) |
| 1997 |
|---|
| 3 | EE | Laura Gagliardi,
Gian Luigi Bendazzoli,
Stefano Evangelisti:
Direct-list algorithm for configuration interaction calculations.
Journal of Computational Chemistry 18(11): 1329-1343 (1997) |
| 1996 |
|---|
| 2 | | Roberto Ansaloni,
Stefano Evangelisti,
Elda Rossi:
A One-Billion-Determinant Full-CI Benchmark on the Cray T3D.
HPCN Europe 1996: 997-998 |
| 1995 |
|---|
| 1 | | Roberto Ansaloni,
Elda Rossi,
Stefano Evangelisti:
Porting and optimizing a quantum-chemistry FCI algorithm on the Cray T3D.
HPCN Europe 1995: 488-495 |
