de Macedo LG - Search Results

1

The interaction of CCl₄ with Ng (Ng = He, Ne, Ar), O₂, D₂O and ND₃: rovibrational energies, spectroscopic constants and theoretical calculations.

de Oliveira RM, Roncaratti LF, de Macedo LG, Gargano R. de Oliveira RM, et al. Among authors: de macedo lg. J Mol Model. 2017 Mar;23(3):87. doi: 10.1007/s00894-017-3269-0. Epub 2017 Feb 21. J Mol Model. 2017. PMID: 28224331

2

Computational study of Th(4+) and Np(4+) hydration and hydrolysis of Th(4+) from first principles.

Amador DH, Sambrano JR, Gargano R, de Macedo LG. Amador DH, et al. Among authors: de macedo lg. J Mol Model. 2017 Mar;23(3):69. doi: 10.1007/s00894-017-3252-9. Epub 2017 Feb 14. J Mol Model. 2017. PMID: 28197840

3

Erratum to: Computational study of Th⁴⁺ and Np⁴⁺ hydration and hydrolysis of Th⁴⁺ from first principles.

Amador DH, Sambrano JR, Gargano R, de Macedo LG. Amador DH, et al. Among authors: de macedo lg. J Mol Model. 2017 Apr;23(4):100. doi: 10.1007/s00894-017-3293-0. J Mol Model. 2017. PMID: 28251347 No abstract available.

4

Quantum isotope effects on the H+Li₂ reaction.

da Cunha TF, Rivera Vila HV, Ferreira da Cunha W, de Macedo LG, Gargano R. da Cunha TF, et al. Among authors: de macedo lg. J Mol Model. 2017 Apr;23(4):116. doi: 10.1007/s00894-017-3289-9. Epub 2017 Mar 13. J Mol Model. 2017. PMID: 28289959

5

Fully relativistic prolapse-free Gaussian basis sets: the actinides and 81Tl-88Ra.

de Macedo LG, Angelotti WF, Sambrano JR, de Souza AR. de Macedo LG, et al. Among authors: de souza ar. J Chem Phys. 2008 Sep 14;129(10):106101. doi: 10.1063/1.2976155. J Chem Phys. 2008. PMID: 19044942 No abstract available.

6

Fully relativistic calculations on the potential energy surfaces of the lowest 23 states of molecular chlorine.

de Macedo LG, de Jong WA. de Macedo LG, et al. Among authors: de jong wa. J Chem Phys. 2008 Jan 28;128(4):041101. doi: 10.1063/1.2827457. J Chem Phys. 2008. PMID: 18247920

7

Use of autologous micrografts associated with xenogeneic anorganic bone in vertical bone augmentation procedures with Barbell Technique®.

Cosmo LAM, Coutinho RM, de Macedo LGS, Aloise AC, Jayme SJ, Zeferino JPG, Graziano A, Martinez EF, Moy PK, Pelegrine AA. Cosmo LAM, et al. Among authors: de macedo lgs. Clin Implant Dent Relat Res. 2024 Dec;26(6):1289-1302. doi: 10.1111/cid.13387. Epub 2024 Sep 20. Clin Implant Dent Relat Res. 2024. PMID: 39302718

8

Barbell Technique for Three-Dimensional Bone Augmentation.

Nunes MP, de Macedo LGS, Santamaria MP, Ribeiro JC, Moy PK, Pelegrine AA. Nunes MP, et al. Among authors: de macedo lgs. Case Rep Dent. 2023 Nov 9;2023:4180372. doi: 10.1155/2023/4180372. eCollection 2023. Case Rep Dent. 2023. PMID: 38020962 Free PMC article.

9

Relativistic four-component MRCISD+Q calculations of the six lowest valence states of molecular [Formula: see text] anion including breit interactions.

de Macedo LGM, de Castro Vieira YC, de Oliveira RM, Gargano R. de Macedo LGM, et al. J Mol Model. 2023 Jun 13;29(7):207. doi: 10.1007/s00894-023-05564-x. J Mol Model. 2023. PMID: 37310506

10

Electronic and dynamical properties of non-covalent diatomic aggregates formed by He with neutral and ionic Li and Be.

de Jesus GCC, Costa CVS, de Macedo LGM, de Oliveira Neto PH, Pirani F, Gargano R. de Jesus GCC, et al. Among authors: de macedo lgm. J Mol Model. 2023 May 30;29(6):190. doi: 10.1007/s00894-023-05512-9. J Mol Model. 2023. PMID: 37249738

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