Literature DB >> 24532191

LUMPAC lanthanide luminescence software: Efficient and user friendly.

José Diogo L Dutra1, Thiago D Bispo2, Ricardo O Freire1.   

Abstract

In this study, we will be presenting LUMPAC (LUMinescence PACkage), which was developed with the objective of making possible the theoretical study of lanthanide-based luminescent systems. This is the first software that allows the study of luminescent properties of lanthanide-based systems. Besides being a computationally efficient software, LUMPAC is user friendly and can be used by researchers who have no previous experience in theoretical chemistry. With this new tool, we hope to enable research groups to use theoretical tools on projects involving systems that contain lanthanide ions.
Copyright © 2014 Wiley Periodicals, Inc.

Entities:  

Keywords:  LUMPAC; europium; lanthanide; luminescence; rare earth; software; sparkle model

Year:  2014        PMID： 24532191     DOI： 10.1002/jcc.23542

Source DB:  PubMed          Journal:  J Comput Chem        ISSN： 0192-8651            Impact factor:   3.376


  10 in total

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Authors:  Caroline B Azevedo; TúlioM Batista; Emerson H de Faria; Lucas A Rocha; Katia J Ciuffi; Eduardo J Nassar
Journal:  J Fluoresc       Date:  2015-02-17       Impact factor: 2.217

2.  Red-emitting β-diketonate Eu(III) Complexes With Substituted 1,10-phenanthroline Derivatives: Optoelectronic and Spectroscopic Analysis.

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Journal:  J Fluoresc       Date:  2022-04-19       Impact factor: 2.525

3.  Novel fluorescent nano-sensor based on amino-functionalization of Eu3+:SrSnO3 for copper ion detection in food and real drink water samples.

Authors:  Z Ghubish; R Kamal; Hala R Mahmoud; M Saif; H Hafez; M El-Kemary
Journal:  RSC Adv       Date:  2021-05-22       Impact factor: 4.036

4.  Chemical Partition of the Radiative Decay Rate of Luminescence of Europium Complexes.

Authors:  Nathalia B D Lima; José Diogo L Dutra; Simone M C Gonçalves; Ricardo O Freire; Alfredo M Simas
Journal:  Sci Rep       Date:  2016-02-19       Impact factor: 4.379

5.  Chiral transcription in self-assembled tetrahedral Eu4L6 chiral cages displaying sizable circularly polarized luminescence.

Authors:  Chi-Tung Yeung; King-Him Yim; Ho-Yin Wong; Robert Pal; Wai-Sum Lo; Siu-Cheong Yan; Melody Yee-Man Wong; Dmitry Yufit; Danil E Smiles; Laura J McCormick; Simon J Teat; David K Shuh; Wing-Tak Wong; Ga-Lai Law
Journal:  Nat Commun       Date:  2017-10-24       Impact factor: 14.919

6.  A stoichiometric terbium-europium dyad molecular thermometer: energy transfer properties.

Authors:  Guochen Bao; Ka-Leung Wong; Dayong Jin; Peter A Tanner
Journal:  Light Sci Appl       Date:  2018-11-28       Impact factor: 17.782

7.  Self-referenced method for the Judd-Ofelt parametrisation of the Eu3+ excitation spectrum.

Authors:  Aleksandar Ćirić; Łukasz Marciniak; Miroslav D Dramićanin
Journal:  Sci Rep       Date:  2022-01-12       Impact factor: 4.379

8.  Ancillary ligand modulated stereoselective self-assembly of triple-stranded Eu(iii) helicate featuring circularly polarized luminescence.

Authors:  Zhiwei Yao; Yanyan Zhou; Ting Gao; Pengfei Yan; Hongfeng Li
Journal:  RSC Adv       Date:  2021-03-10       Impact factor: 3.361

9.  Europium Luminescence: Electronic Densities and Superdelocalizabilities for a Unique Adjustment of Theoretical Intensity Parameters.

Authors:  José Diogo L Dutra; Nathalia B D Lima; Ricardo O Freire; Alfredo M Simas
Journal:  Sci Rep       Date:  2015-09-02       Impact factor: 4.379

10.  Multireference Ab Initio Investigation on Ground and Low-Lying Excited States: Systematic Evaluation of J-J Mixing in a Eu3+ Luminescent Complex.

Authors:  Luca Babetto; Silvia Carlotto; Alice Carlotto; Marzio Rancan; Gregorio Bottaro; Lidia Armelao; Maurizio Casarin
Journal:  Inorg Chem       Date:  2020-12-15       Impact factor: 5.165
  10 in total

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