New Relativistic ANO Basis Sets for Transition Metal Atoms
Article Properties
-
LanguageEnglish
-
DOI (url)
-
Publication Date2005/07/01
-
Indian UGC (journal)
-
Refrences22
-
Citations876
-
Björn O. Roos Department of Theoretical Chemistry, Chemical Center, P.O.B. 124, SE−221 00 Lund, Sweden
-
Roland Lindh Department of Theoretical Chemistry, Chemical Center, P.O.B. 124, SE−221 00 Lund, Sweden
-
Per-Åke Malmqvist Department of Theoretical Chemistry, Chemical Center, P.O.B. 124, SE−221 00 Lund, Sweden
-
Valera Veryazov Department of Theoretical Chemistry, Chemical Center, P.O.B. 124, SE−221 00 Lund, Sweden
-
Per-Olof Widmark Department of Theoretical Chemistry, Chemical Center, P.O.B. 124, SE−221 00 Lund, Sweden
Journal Categories
Science
Chemistry
Science
Chemistry
Physical and theoretical chemistry
Science
Physics
Atomic physics
Constitution and properties of matter
You May Also Like
- The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals
- Auxiliary basis sets for main row atoms and transition metals and their use to approximate Coulomb potentials
- RI-MP2: first derivatives and global consistency
- Configuration interaction calculations on the nitrogen molecule
- A new energy decomposition scheme for molecular interactions within the Hartree‐Fock approximation
Refrences
| Title | Journal | Journal Categories | Citations | Publication Date |
|---|---|---|---|---|
| A modified definition of the zeroth-order Hamiltonian in multiconfigurational perturbation theory (CASPT2) | Chemical Physics Letters |
| 828 | 2004 |
| Main Group Atoms and Dimers Studied with a New Relativistic ANO Basis Set | The Journal of Physical Chemistry A |
| 1,035 | 2004 |
| II: PROPERTIES OF DIATOMIC AND TRIATOMIC MOLECULES | Molecular Physics |
| 14 | 2003 |
| 10.1016/S0927-0256(03)00109-5 | Computational Materials Science |
| 2003 | |
| 10.1016/S0009-2614(02)00498-0 | Chemical Physics Letters |
| 2002 |
Refrences Analysis
The category
Science: Chemistry: Physical and theoretical chemistry 18
is the most frequently represented among the references in this article. It primarily includes studies from Chemical Physics Letters and Theoretica chimica acta. The chart below illustrates the number of referenced publications per year.
Refrences used by this article by year
Citations
Citations Analysis
The category
Science: Chemistry 780
is the most commonly referenced area in studies that cite this article. The first research to cite this article was titled Ab initio calculation of electronic absorption spectra and ionization potentials of C3H3 radicals and was published in 2005. The most recent citation comes from a 2024 study titled ZORA Basis Sets of 5 and 6 Zeta Valence Qualities for H-Ar: Application in Calculations of Atomic and Molecular Properties. This article reached its peak citation in 2020, with 64 citations. It has been cited in 104 different journals, 12% of which are open access. Among related journals, the The Journal of Physical Chemistry A cited this research the most, with 97 citations. The chart below illustrates the annual citation trends for this article.