Angeli C - Search Results

1

Mapping of Hückel zigzag carbon nanotubes onto independent polyene chains: Application to periodic nanotubes.

François G, Angeli C, Bendazzoli GL, Brumas V, Evangelisti S, Berger JA. François G, et al. Among authors: angeli c. J Chem Phys. 2023 Sep 7;159(9):094106. doi: 10.1063/5.0153075. J Chem Phys. 2023. PMID: 37671957

2

A theoretical study of Be(N) linear chains: variational and perturbative approaches.

Pastore M, Monari A, Angeli C, Bendazzoli GL, Cimiraglia R, Evangelisti S. Pastore M, et al. Among authors: angeli c. J Chem Phys. 2009 Jul 21;131(3):034309. doi: 10.1063/1.3185351. J Chem Phys. 2009. PMID: 19624199

3

The localization tensor for the H2 molecule: closed formulae for the Heitler-London and related wavefunctions and comparison with full configuration interaction.

Angeli C, Bendazzoli GL, Evangelisti S. Angeli C, et al. J Chem Phys. 2013 Feb 7;138(5):054314. doi: 10.1063/1.4789493. J Chem Phys. 2013. PMID: 23406126

4

The localization spread and polarizability of rings and periodic chains.

Angeli C, Bendazzoli GL, Evangelisti S, Berger JA. Angeli C, et al. J Chem Phys. 2021 Sep 28;155(12):124107. doi: 10.1063/5.0056226. J Chem Phys. 2021. PMID: 34598588

5

Can the second order multireference perturbation theory be considered a reliable tool to study mixed-valence compounds?

Pastore M, Helal W, Evangelisti S, Leininger T, Malrieu JP, Maynau D, Angeli C, Cimiraglia R. Pastore M, et al. Among authors: angeli c. J Chem Phys. 2008 May 7;128(17):174102. doi: 10.1063/1.2911699. J Chem Phys. 2008. PMID: 18465905

6

Behavior of the Position-Spread Tensor in Diatomic Systems.

Brea O, El Khatib M, Angeli C, Bendazzoli GL, Evangelisti S, Leininger T. Brea O, et al. Among authors: angeli c. J Chem Theory Comput. 2013 Dec 10;9(12):5286-95. doi: 10.1021/ct400453b. Epub 2013 Nov 21. J Chem Theory Comput. 2013. PMID: 26592266

7

The Spin-Partitioned Total-Position Spread Tensor: An Application To Diatomic Molecules.

Brea O, El Khatib M, Bendazzoli GL, Evangelisti S, Leininger T, Angeli C. Brea O, et al. Among authors: angeli c. J Phys Chem A. 2016 Jul 14;120(27):5230-8. doi: 10.1021/acs.jpca.6b01043. Epub 2016 Apr 28. J Phys Chem A. 2016. PMID: 27014834

8

Beryllium dimer: a bond based on non-dynamical correlation.

El Khatib M, Bendazzoli GL, Evangelisti S, Helal W, Leininger T, Tenti L, Angeli C. El Khatib M, et al. Among authors: angeli c. J Phys Chem A. 2014 Aug 21;118(33):6664-73. doi: 10.1021/jp503145u. Epub 2014 Jun 12. J Phys Chem A. 2014. PMID: 24866399

9

The Effect of the Basis-Set Superposition Error on the Calculation of Dispersion Interactions: A Test Study on the Neon Dimer.

Monari A, Bendazzoli GL, Evangelisti S, Angeli C, Ben Amor N, Borini S, Maynau D, Rossi E. Monari A, et al. Among authors: angeli c. J Chem Theory Comput. 2007 Mar;3(2):477-85. doi: 10.1021/ct6003005. J Chem Theory Comput. 2007. PMID: 26637029

10

FORTRAN interface for code interoperability in quantum chemistry: the Q5Cost library.

Borini S, Monari A, Rossi E, Tajti A, Angeli C, Bendazzoli GL, Cimiraglia R, Emerson A, Evangelisti S, Maynau D, Sanchez-Marin J, Szalay PG. Borini S, et al. Among authors: angeli c. J Chem Inf Model. 2007 May-Jun;47(3):1271-7. doi: 10.1021/ci7000567. Epub 2007 May 11. J Chem Inf Model. 2007. PMID: 17492830

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My NCBI Filters

Text availability

Article attribute

Article type

Publication date

187 results

Search Page