Publicaciones

@article{SilvaAndrade2022,

title = {Comparative Genomics of Clostridium baratii Reveals Strain-Level Diversity in Toxin Abundance},

author = {Claudia Silva-Andrade and Alberto J. Martin and Daniel Garrido},

url = {https://doi.org/10.3390/microorganisms10020213},

doi = {10.3390/microorganisms10020213},

year  = {2022},

date = {2022-01-01},

journal = {Microorganisms},

volume = {10},

number = {2},

pages = {213},

publisher = {MDPI AG},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Valencia2022,

title = {Nanoindentation of nanoporous tungsten: A molecular dynamics approach},

author = {Felipe J. Valencia and Robinson Ortega and Rafael I. González and Eduardo M. Bringa and Miguel Kiwi and Carlos J. Ruestes},

url = {https://doi.org/10.1016/j.commatsci.2022.111336},

doi = {10.1016/j.commatsci.2022.111336},

year  = {2022},

date = {2022-06-01},

journal = {Computational Materials Science},

volume = {209},

pages = {111336},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Angel2022,

title = {Computational chemistry advances on benzodithiophene-based organic photovoltaic materials},

author = {Felipe A. Angel and María B. Camarada and Ignacio A. Jessop},

url = {https://doi.org/10.1080/10408436.2022.2052798},

doi = {10.1080/10408436.2022.2052798},

year  = {2022},

date = {2022-03-01},

journal = {Critical Reviews in Solid State and Materials Sciences},

pages = {1--28},

publisher = {Informa UK Limited},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{GomezLobo2022,

title = {Urban Commuting Time and Sick-Leave Medical License Use: An Empirical Study of Santiago, Chile},

author = {Andres Gomez Lobo and Alejandro Micco},

url = {https://doi.org/10.2139/ssrn.4009706},

doi = {10.2139/ssrn.4009706},

year  = {2022},

date = {2022-01-01},

journal = {SSRN Electronic Journal},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Casas2022,

title = {A heuristic search based on diversity for solving combinatorial problems},

author = {Francisco Casas and Claudio E. Torres and Ignacio Araya},

url = {https://doi.org/10.1007/s10732-022-09494-4},

doi = {10.1007/s10732-022-09494-4},

year  = {2022},

date = {2022-04-01},

journal = {Journal of Heuristics},

publisher = {Springer Science and Business Media LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Castro2022,

title = {Enhancing the magnetic response on polycrystalline nanoframes through mechanical deformation},

author = {Mario Castro and Samuel E. Baltazar and Javier Rojas-Nunez and Eduardo Bringa and Felipe J. Valencia and Sebastian Allende},

url = {https://doi.org/10.1038/s41598-022-09647-2},

doi = {10.1038/s41598-022-09647-2},

year  = {2022},

date = {2022-04-01},

journal = {Scientific Reports},

volume = {12},

number = {1},

publisher = {Springer Science and Business Media LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Molinet2022,

title = {A Saccharomyces eubayanus haploid resource for research studies},

author = {Jennifer Molinet and Kamila Urbina and Claudia Villegas and Valentina Abarca and Christian I. Oporto and Pablo Villarreal and Carlos A. Villarroel and Francisco Salinas and Roberto F. Nespolo and Francisco A. Cubillos},

url = {https://doi.org/10.1038/s41598-022-10048-8},

doi = {10.1038/s41598-022-10048-8},

year  = {2022},

date = {2022-04-01},

journal = {Scientific Reports},

volume = {12},

number = {1},

publisher = {Springer Science and Business Media LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Singh2022,

title = {High-temperature phonon-mediated superconductivity in monolayer Mg2B4C2},

author = {Sobhit Singh and Aldo H. Romero and José D. Mella and Vitalie Eremeev and Enrique Muñoz and Anastassia N. Alexandrova and Karin M. Rabe and David Vanderbilt and Francisco Muñoz},

url = {https://doi.org/10.1038/s41535-022-00446-6},

doi = {10.1038/s41535-022-00446-6},

year  = {2022},

date = {2022-04-01},

journal = {npj Quantum Materials},

volume = {7},

number = {1},

publisher = {Springer Science and Business Media LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{MenndezProupin2022,

title = {Mixed-anion mixed-cation perovskite (FAPbI$łess$sub$greater$3$łess$/sub$greater$)$łess$sub$greater$0.875$łess$/sub$greater$(MAPbBr$łess$sub$greater$3$łess$/sub$greater$)$łess$sub$greater$0.125$łess$/sub$greater$: an $łess$i$greater$ab initio$łess$/i$greater$ molecular dynamics study},

author = {Eduardo Menéndez-Proupin and Shivani Grover and Ana L. Montero-Alejo and Scott D. Midgley and Keith T. Butler and Ricardo Grau-Crespo},

url = {https://doi.org/10.1039/d1ta10860c},

doi = {10.1039/d1ta10860c},

year  = {2022},

date = {2022-01-01},

journal = {Journal of Materials Chemistry A},

publisher = {Royal Society of Chemistry (RSC)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{HenrquezVargas2022,

title = {Evaluation of Interpolation Scheme Alternatives and Variation of the Number of Slave Cells in a Cut-Cell Methodology},

author = {Luis Henríquez-Vargas and Francisco Angel and Lawrence Lackey and Pablo Donoso-García},

url = {https://doi.org/10.3390/math10060895},

doi = {10.3390/math10060895},

year  = {2022},

date = {2022-03-01},

journal = {Mathematics},

volume = {10},

number = {6},

pages = {895},

publisher = {MDPI AG},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{CortsArriagada2022,

title = {A first-principles study on the adsorption properties of phosphorene oxide for pollutant removal from water},

author = {Diego Cortés-Arriagada and Natacha Barria and Daniela E. Ortega and Ingrid Araya-Durán and María Belén Camarada},

url = {https://doi.org/10.1016/j.molliq.2022.119103},

doi = {10.1016/j.molliq.2022.119103},

year  = {2022},

date = {2022-07-01},

journal = {Journal of Molecular Liquids},

volume = {357},

pages = {119103},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Gyebi2022,

title = {African derived phytocompounds may interfere with SARS-CoV-2 RNA capping machinery via inhibition of 2$prime$-O-ribose methyltransferase: An in silico perspective},

author = {Gideon A. Gyebi and Oludare M. Ogunyemi and Adedotun A. Adefolalu and Alejandro Rodríguez-Martínez and Juan F. López-Pastor and Antonio J. Banegas-Luna and Horacio Pérez-Sánchez and Adegbenro P. Adegunloye and Olalekan B. Ogunro and Saheed O. Afolabi},

url = {https://doi.org/10.1016/j.molstruc.2022.133019},

doi = {10.1016/j.molstruc.2022.133019},

year  = {2022},

date = {2022-08-01},

journal = {Journal of Molecular Structure},

volume = {1262},

pages = {133019},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Bez2022,

title = {Automatic Extraction of Nested Entities in Clinical Referrals in Spanish},

author = {Pablo Báez and Felipe Bravo-Marquez and Jocelyn Dunstan and Matías Rojas and Fabián Villena},

url = {https://doi.org/10.1145/3498324},

doi = {10.1145/3498324},

year  = {2022},

date = {2022-07-01},

journal = {ACM Transactions on Computing for Healthcare},

volume = {3},

number = {3},

pages = {1--22},

publisher = {Association for Computing Machinery (ACM)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Ortega2022,

title = {Tailoring the arsenic(III) removal ability from water using metal-organic frameworks via metal exchange – A computational study},

author = {Daniela E. Ortega and Diego Cortés-Arriagada and Erwin García- Hernández},

url = {https://doi.org/10.1016/j.molliq.2022.119167},

doi = {10.1016/j.molliq.2022.119167},

year  = {2022},

date = {2022-07-01},

journal = {Journal of Molecular Liquids},

volume = {358},

pages = {119167},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Daz2022,

title = {Preference Estimation under Bounded Rationality: Identification of Attribute Non-Attendance in Stated-Choice Data Using a Support Vector Machines Approach},

author = {Verónica Díaz and Ricardo Montoya and Sebastián Maldonado},

url = {https://doi.org/10.1016/j.ejor.2022.04.018},

doi = {10.1016/j.ejor.2022.04.018},

year  = {2022},

date = {2022-04-01},

journal = {European Journal of Operational Research},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{AcuaCastillo2022,

title = {First Identification of Reinfection by a Genetically Different Variant of SARS-CoV-2 in a Homeless Person from the Metropolitan Area of Santiago, Chile},

author = {Claudio Acuña-Castillo and Mabel Vidal and Ailen Inostroza-Molina and Eva Vallejos-Vidal and Roberto Luraschi and Maximiliano Figueroa and Carlos Barrera-Avalos and Rodrigo Vera and Sergio Vargas and Daniel Valdes and Kevin Maisey and Mónica Imarai and Elías Leiva-Salcedo and Alejandro Escobar and Sebastián Reyes-Cerpa and Alexis Gaete and Ricardo Palma-Vejares and Dante Travisany and Leonel E. Rojo and Felipe E. Reyes-López and Ana María Sandino},

editor = {Marco Dettori},

url = {https://doi.org/10.1155/2022/3859071},

doi = {10.1155/2022/3859071},

year  = {2022},

date = {2022-04-01},

journal = {Journal of Environmental and Public Health},

volume = {2022},

pages = {1--6},

publisher = {Hindawi Limited},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Happel2022,

title = {Stability of the Microbiome of the Sponge Mycale (Oxymycale) acerata in the Western Antarctic Peninsula},

author = {Lea Happel and Rodolfo Rondon and Alejandro Font and Marcelo González-Aravena and César A. Cárdenas},

url = {https://doi.org/10.3389/fmicb.2022.827863},

doi = {10.3389/fmicb.2022.827863},

year  = {2022},

date = {2022-04-01},

journal = {Frontiers in Microbiology},

volume = {13},

publisher = {Frontiers Media SA},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Canals2022,

title = {Mechanisms Underlying Choice-Set Formation: The Case of School Choice in Chile},

author = {Catalina Canals and Spiro Maroulis and Enrique Canessa and Sergio Chaigneau and Alejandra Mizala},

url = {https://doi.org/10.1177/08944393221088659},

doi = {10.1177/08944393221088659},

year  = {2022},

date = {2022-05-01},

journal = {Social Science Computer Review},

pages = {089443932210886},

publisher = {SAGE Publications},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Napoles2022,

title = {Recurrence-Aware Long-Term Cognitive Network for Explainable Pattern Classification},

author = {Gonzalo Napoles and Yamisleydi Salgueiro and Isel Grau and Maikel Leon Espinosa},

url = {https://doi.org/10.1109/tcyb.2022.3165104},

doi = {10.1109/tcyb.2022.3165104},

year  = {2022},

date = {2022-01-01},

journal = {IEEE Transactions on Cybernetics},

pages = {1--12},

publisher = {Institute of Electrical and Electronics Engineers (IEEE)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{RamosGuzmn2022,

title = {Testing Affordable Strategies for the Computational Study of Reactivity in Cysteine Proteases: The Case of SARS-CoV-2 3CL Protease Inhibition},

author = {Carlos A. Ramos-Guzmán and José Luis Velázquez-Libera and J. Javier Ruiz-Pernía and Iñaki Tuñón},

url = {https://doi.org/10.1021/acs.jctc.2c00294},

doi = {10.1021/acs.jctc.2c00294},

year  = {2022},

date = {2022-05-01},

journal = {Journal of Chemical Theory and Computation},

publisher = {American Chemical Society (ACS)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Thimmakondu2022,

title = {Why an integrated approach between search algorithms and chemical intuition is necessary?},

author = {Venkatesan S. Thimmakondu and Aland Sinjari and Diego Inostroza and Pothiappan Vairaprakash and Krishnan Thirumoorthy and Saikat Roy and Anakuthil Anoop and William Tiznado},

url = {https://doi.org/10.1039/d2cp00315e},

doi = {10.1039/d2cp00315e},

year  = {2022},

date = {2022-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {24},

number = {19},

pages = {11680--11686},

publisher = {Royal Society of Chemistry (RSC)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Lpez2022,

title = {Mixing the Solar Wind Proton and Electron Scales. Theory and 2D-PIC Simulations of Firehose Instability},

author = {R. A. López and A. Micera and M. Lazar and S. Poedts and G. Lapenta and A. N. Zhukov and E. Boella and S. M. Shaaban},

url = {https://doi.org/10.3847/1538-4357/ac66e4},

doi = {10.3847/1538-4357/ac66e4},

year  = {2022},

date = {2022-05-01},

journal = {The Astrophysical Journal},

volume = {930},

number = {2},

pages = {158},

publisher = {American Astronomical Society},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Vidable2022,

title = {Simulations of plasticity in diamond nanoparticles showing ultrahigh strength},

author = {G. Garcia Vidable and R. I. Gonzalez and F. J. Valencia and N. Amigo and D. Tramontina and E. M. Bringa},

url = {https://doi.org/10.1016/j.diamond.2022.109109},

doi = {10.1016/j.diamond.2022.109109},

year  = {2022},

date = {2022-05-01},

journal = {Diamond and Related Materials},

pages = {109109},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Parreira2022,

title = {Analysis of the host–guest complex formation involving bridged hexameric pyridinium–phenyl rings in the HexaCage6$mathplus$ host in suit[3]ane: insights from dispersion-corrected DFT calculations for a nanometric mechanically interlocked device},

author = {Renato L. T. Parreira and Giovanni F. Caramori and Letícia Maria Pequeno Madureira and Raul Guajardo-Maturana and Peter. L. Rodríguez-Kessler and Alvaro Muñoz-Castro},

url = {https://doi.org/10.1007/s40097-022-00497-y},

doi = {10.1007/s40097-022-00497-y},

year  = {2022},

date = {2022-05-01},

journal = {Journal of Nanostructure in Chemistry},

publisher = {Springer Science and Business Media LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Kuznetsov2022,

title = {A Computational approach toward organometallic ruthenium(II) compounds with tunable hydrolytic properties},

author = {Aleksey E. Kuznetsov and Franz A. Thomet},

url = {https://doi.org/10.1016/j.chemphys.2022.111587},

doi = {10.1016/j.chemphys.2022.111587},

year  = {2022},

date = {2022-08-01},

journal = {Chemical Physics},

volume = {560},

pages = {111587},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Priatama2022-ka,

title = {Regression models for estimating aboveground biomass and stand 

 volume using Landsat-based indices in post-mining area},

author = {A R Priatama and https://journal.ipb.ac.id/index.php/jmht/article/view/33983/23160 and Y Setiawan},

year  = {2022},

date = {2022-04-01},

journal = {J. Manaj. Hutan Trop. (J. Trop. For. Manag.)},

volume = {28},

number = {1},

pages = {1--14},

publisher = {Department of Forest Management},

abstract = {This paper describes the use of remotely sensed data to measure 

 vegetation variables such as basal area, biomass and stand 

 volume. The objective of this research was developed regression 

 models to estimate basal area (BA), aboveground biomass (AGB), 

 and stand volume (SV) using Landsat-based vegetation indices. 

 The examined vegetation indices were SAVI, MSAVI, EVI, NBR, NBR2 

 and NDMI. Regression models were developed based on 

 least-squared method using several forms of equation, i.e., 

 linear, exponential, power, logarithm and polynomial. Among 

 those models, it was recognized that the best fit of model was obtained from the exponential model, log (y) = ax + b for 

 estimating BA, AGB & SV. The MSAVI had been identified as the 

 most accurate independent variable to estimates basal area with 

 R² of 0.70 and average verification values of 16.39% 

 (4%32.66%); while the EVI become the best independent 

 variable for estimating aboveground biomass (AGB) with R2 of 

 0.72 and average of verification values of 18,10% 

 (9%-28.01%); and the NDMI was recognized to be the best 

 independent variable to estimate stand volume with R2 of 0.69 

 and average of verification values of 24.37% (-15%-38.11%).},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Inkov2022-wo,

title = {Elite crisis in ancient Russia: the Ryazan princes' murder in 

 Isady in 1217 and its assessment in Russian historiography},

author = {Aleksandr Aleksandrovich Inkov and https://panor.ru/articles/krizis-elit-v-drevney-rusi-ubiystvo-ryazanskikh-knyazey-v-isadakh-1217-g-i-ego-otsenki-v-rossiyskoy-istoriografii/78858.html},

year  = {2022},

date = {2022-01-01},

journal = {Academic Council},

number = {2},

pages = {126--132},

publisher = {PANORAMA Publishing House},

abstract = {The article is devoted to one of the key events in ancient 

 Russian history at the beginning of the 13th century. On July 

 20, 1217, on the commemoration day of the holy prophet Elias, 

 the Ryazan princes Gleb and Konstantin Vladimirovich killed six 

 of their closest relatives right during the princely congress in 

 the Isady village. Despite the fact that conspiracies and 

 murders were not uncommon in the Rurik dynasty, this monstrous 

 massacre far surpassed in its scale all previous similar crimes 

 in the history of pre-Mongol Russia. The author considers this 

 event, as well as its assessment in the Russian historical 

 literature.},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Setyadi2022-ze,

title = {Preferensi Konsumsi Daging Sapi oleh Masyarakat Tionghoa di Kota 

 Pontianak},

author = {Anselmus Setyadi and https://jepa.ub.ac.id/index.php/jepa/article/view/945#articleAbstract and Eva Dolorosa and Marisi Aritonang},

year  = {2022},

date = {2022-01-01},

journal = {J. Ekon. Pertan. dan Agribisnis},

volume = {6},

number = {1},

pages = {293--303},

publisher = {Brawijaya University},

abstract = {Penelitian ini bertujuan untuk mengetahui atribut yang 

 berpengaruh terhadap preferensi serta tingkat preferensi 

 konsumsi daging sapi oleh masyarakat Tionghoa di Kota Pontianak. 

 Penelitian menggunakan metoe survei dengan jumlah sampel 

 ditentukan secara purposive sebanyak 100 responden. Semua 

 responden adalah masyarakat Tionghoa di wilayah Kota Pontianak 

 yang mengkonsumsi daging sapi. Analisis yang digunakan adalah 

 analisis Konjoin. Hasil analisis konjoin menunjukan bahwa 

 masyarakat Tionghoa menyukai daging sapi dengan ciri daging 

 berwarna merah terang, bertekstur empuk, lemak sedikit dan 

 daging tanpa lemak, ukuran pembelian},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Pavez2022,

title = {Shallow and Deep Electric Structures in the Tolhuaca Geothermal System (S. Chile) Investigated by Magnetotellurics},

author = {Maximiliano Pavez and Daniel Diaz and Heinrich Brasse and Gerhard Kapinos and Ingmar Budach and Valentin Goldberg and Diego Morata and Eva Schill},

url = {https://doi.org/10.3390/rs14236144},

doi = {10.3390/rs14236144},

year  = {2022},

date = {2022-12-01},

journal = {Remote Sensing},

volume = {14},

number = {23},

pages = {6144},

publisher = {MDPI AG},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Rojas2022c,

title = {Coupling Cell Communication and Optogenetics: Implementation of a Light-Inducible Intercellular System in Yeast},

author = {Vicente Rojas and Luis F. Larrondo},

url = {https://doi.org/10.1021/acssynbio.2c00338},

doi = {10.1021/acssynbio.2c00338},

year  = {2022},

date = {2022-12-01},

journal = {ACS Synthetic Biology},

volume = {12},

number = {1},

pages = {71–82},

publisher = {American Chemical Society (ACS)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Gyebi2022b,

title = {Antimalarial phytochemicals as potential inhibitors of SARS-CoV-2 guanine N7-methyltransferase (nsp 14): an integrated computational approach},

author = {Gideon A. Gyebi and Oludare M. Ogunyemi and Adedotun A. Adefolalu and Juan F. López-Pastor and Antonio J. Banegas-Luna and Alejandro Rodríguez-Martínez and Horacio Pérez-Sánchez and Adegbenro P. Adegunloye and Olalekan B. Ogunro and Saheed O. Afolabi and Alaa Baazeem and Saqer S. Alotaibi and Gaber El-Saber Batiha},

url = {https://doi.org/10.1080/07391102.2022.2078408},

doi = {10.1080/07391102.2022.2078408},

year  = {2022},

date = {2022-05-01},

journal = {Journal of Biomolecular Structure and Dynamics},

pages = {1--23},

publisher = {Informa UK Limited},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{ForeroDoria2022,

title = {An In Vitro and In Silico Study of Antioxidant Properties of Curcuminoid N-alkylpyridinium Salts: Initial Assessment of Their Antitumoral Properties},

author = {Oscar Forero-Doria and Luis Guzmán and Felipe Jiménez-Aspee and Javier Echeverría and Sergio Wehinger and Claudio Valenzuela and Ramiro Araya-Maturana and Maximiliano Martínez-Cifuentes},

url = {https://doi.org/10.3390/antiox11061104},

doi = {10.3390/antiox11061104},

year  = {2022},

date = {2022-06-01},

journal = {Antioxidants},

volume = {11},

number = {6},

pages = {1104},

publisher = {MDPI AG},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Liu2022,

title = {A conjugated Schiff-base macrocycle weakens the transverse crystal field of air-stable dysprosium single-molecule magnets},

author = {Shuting Liu and Yolimar Gil and Chen Zhao and Jinjiang Wu and Zhenhua Zhu and Xiao-Lei Li and Daniel Aravena and Jinkui Tang},

url = {https://doi.org/10.1039/d2qi01565j},

doi = {10.1039/d2qi01565j},

year  = {2022},

date = {2022-01-01},

journal = {Inorganic Chemistry Frontiers},

publisher = {Royal Society of Chemistry (RSC)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Krid2022,

title = {Host–guest binding selectivity of ethylated pillar[5]arene (EtP5A) towards octane, 1, 7-octadiene, and 1, 7-octadiyne: a computational investigation},

author = {Adel Krid and Lotfi Belkhiri and Hamza Allal and Aleksey Kuznetsov and Abdou Boucekkine},

url = {https://doi.org/10.1007/s11224-022-02002-1},

doi = {10.1007/s11224-022-02002-1},

year  = {2022},

date = {2022-07-01},

journal = {Structural Chemistry},

volume = {34},

number = {2},

pages = {625–638},

publisher = {Springer Science and Business Media LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Amigo2022b,

title = {Cryogenic thermal cycling rejuvenation in metallic glasses: Structural and mechanical assessment},

author = {Nicolás Amigo},

url = {https://doi.org/10.1016/j.jnoncrysol.2022.121850},

doi = {10.1016/j.jnoncrysol.2022.121850},

year  = {2022},

date = {2022-11-01},

journal = {Journal of Non-Crystalline Solids},

volume = {596},

pages = {121850},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{N2022,

title = {Experimental and DFT studies of selenium decorated graphene oxide: Redox stability, cytotoxicity, and corrosion inhibition of AZ13 Mg alloy},

author = {Palaniappan N and I. S. Cole and A. Kuznetsov and K. R. Justin Thomas and P. Ruszkowski and M. Kujawska},

url = {https://doi.org/10.1016/j.matchemphys.2022.126870},

doi = {10.1016/j.matchemphys.2022.126870},

year  = {2022},

date = {2022-12-01},

journal = {Materials Chemistry and Physics},

volume = {292},

pages = {126870},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{GarciaVidable2022,

title = {Simulations of plasticity in diamond nanoparticles showing ultrahigh strength},

author = {G. Garcia Vidable and R. I. Gonzalez and F. J. Valencia and N. Amigo and D. Tramontina and E. M. Bringa},

url = {https://doi.org/10.1016/j.diamond.2022.109109},

doi = {10.1016/j.diamond.2022.109109},

year  = {2022},

date = {2022-06-01},

journal = {Diamond and Related Materials},

volume = {126},

pages = {109109},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Amigo2022c,

title = {Cryogenic thermal cycling rejuvenation in metallic glasses: Structural and mechanical assessment},

author = {Nicolás Amigo},

url = {https://doi.org/10.1016/j.jnoncrysol.2022.121850},

doi = {10.1016/j.jnoncrysol.2022.121850},

year  = {2022},

date = {2022-11-01},

journal = {Journal of Non-Crystalline Solids},

volume = {596},

pages = {121850},

publisher = {Elsevier BV},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{BezGrez2022b,

title = {Evaluation of Slight Changes in Aromaticity through Electronic and Density Functional Reactivity Theory-Based Descriptors},

author = {Rodrigo Báez-Grez and Ricardo Pino-Rios},

url = {https://doi.org/10.1021/acsomega.2c02291},

doi = {10.1021/acsomega.2c02291},

year  = {2022},

date = {2022-06-01},

journal = {ACS Omega},

volume = {7},

number = {25},

pages = {21939--21945},

publisher = {American Chemical Society (ACS)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{DenisAlpizar2022,

title = {Quantum Inelastic Scattering of ArHAr$łess$sup$greater$$mathplus$$łess$/sup$greater$, HeHHe$łess$sup$greater$$mathplus$$łess$/sup$greater$, and NeHNe$łess$sup$greater$$mathplus$$łess$/sup$greater$ with He on New Potential Energy Surfaces},

author = {Otoniel Denis-Alpizar and Lisan David Cabrera-González and Dayan Páez-Hernández and Ricardo Pino-Rios},

url = {https://doi.org/10.1021/acsearthspacechem.2c00131},

doi = {10.1021/acsearthspacechem.2c00131},

year  = {2022},

date = {2022-07-01},

journal = {ACS Earth and Space Chemistry},

volume = {6},

number = {7},

pages = {1924--1929},

publisher = {American Chemical Society (ACS)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{LeyvaParra2022b,

title = {Persistent Planar Tetracoordinate Carbon in Global Minima Structures of Silicon-Carbon Clusters},

author = {Luis Leyva-Parra and Diego Inostroza and Osvaldo Yañez and Julio César Cruz and Jorge Garza and Víctor García and William Tiznado},

url = {https://doi.org/10.3390/atoms10010027},

doi = {10.3390/atoms10010027},

year  = {2022},

date = {2022-02-01},

journal = {Atoms},

volume = {10},

number = {1},

pages = {27},

publisher = {MDPI AG},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{SolarEncinas2022,

title = {Bowl-shaped CuB Cluster. A viable Global Minimum with Twofold Aromaticity},

author = {José Solar-Encinas and Luis Leyva-Parra and Osvaldo Yáñez and Diego Inostroza and Julio R. Barrios-Llacuachaqui and Alejandro Vásquez-Espinal and Walter Orellana and William Tiznado},

url = {https://doi.org/10.1002/cphc.202200366},

doi = {10.1002/cphc.202200366},

year  = {2022},

date = {2022-07-01},

journal = {ChemPhysChem},

publisher = {Wiley},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{BuelnaGarca2022b,

title = {Relative Populations and IR Spectra of Cu38 Cluster at Finite Temperature Based on DFT and Statistical Thermodynamics Calculations},

author = {Carlos Emiliano Buelna-García and Cesar Castillo-Quevedo and Jesus Manuel Quiroz-Castillo and Edgar Paredes-Sotelo and Manuel Cortez-Valadez and Martha Fabiola Martin-del-Campo-Solis and Tzarara López-Luke and Marycarmen Utrilla-Vázquez and Ana Maria Mendoza-Wilson and Peter L. Rodríguez-Kessler and Alejandro Vazquez-Espinal and Sudip Pan and Aned Leon-Flores and Jhonny Robert Mis-May and Adán R. Rodríguez-Domínguez and Gerardo Martínez-Guajardo and Jose Luis Cabellos},

url = {https://doi.org/10.3389/fchem.2022.841964},

doi = {10.3389/fchem.2022.841964},

year  = {2022},

date = {2022-03-01},

journal = {Frontiers in Chemistry},

volume = {10},

publisher = {Frontiers Media SA},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Thimmakondu2022b,

title = {Why an integrated approach between search algorithms and chemical intuition is necessary?},

author = {Venkatesan S. Thimmakondu and Aland Sinjari and Diego Inostroza and Pothiappan Vairaprakash and Krishnan Thirumoorthy and Saikat Roy and Anakuthil Anoop and William Tiznado},

url = {https://doi.org/10.1039/d2cp00315e},

doi = {10.1039/d2cp00315e},

year  = {2022},

date = {2022-01-01},

journal = {Physical Chemistry Chemical Physics},

volume = {24},

number = {19},

pages = {11680--11686},

publisher = {Royal Society of Chemistry (RSC)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{BezGrez2022c,

title = {The hidden aromaticity in borazine},

author = {Rodrigo Báez-Grez and Ricardo Pino-Rios},

url = {https://doi.org/10.1039/d1ra06457f},

doi = {10.1039/d1ra06457f},

year  = {2022},

date = {2022-01-01},

journal = {RSC Advances},

volume = {12},

number = {13},

pages = {7906--7910},

publisher = {Royal Society of Chemistry (RSC)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Hoffmann2022b,

title = {Antiferroelectric negative capacitance from a structural phase transition in zirconia},

author = {Michael Hoffmann and Zheng Wang and Nujhat Tasneem and Ahmad Zubair and Prasanna Venkatesan Ravindran and Mengkun Tian and Anthony Arthur Gaskell and Dina Triyoso and Steven Consiglio and Kandabara Tapily and Robert Clark and Jae Hur and Sai Surya Kiran Pentapati and Sung Kyu Lim and Milan Dopita and Shimeng Yu and Winston Chern and Josh Kacher and Sebastian E. Reyes-Lillo and Dimitri Antoniadis and Jayakanth Ravichandran and Stefan Slesazeck and Thomas Mikolajick and Asif Islam Khan},

url = {https://doi.org/10.1038/s41467-022-28860-1},

doi = {10.1038/s41467-022-28860-1},

year  = {2022},

date = {2022-03-01},

journal = {Nature Communications},

volume = {13},

number = {1},

publisher = {Springer Science and Business Media LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Hoffmann2022c,

title = {Antiferroelectric negative capacitance from a structural phase transition in zirconia},

author = {Michael Hoffmann and Zheng Wang and Nujhat Tasneem and Ahmad Zubair and Prasanna Venkatesan Ravindran and Mengkun Tian and Anthony Arthur Gaskell and Dina Triyoso and Steven Consiglio and Kandabara Tapily and Robert Clark and Jae Hur and Sai Surya Kiran Pentapati and Sung Kyu Lim and Milan Dopita and Shimeng Yu and Winston Chern and Josh Kacher and Sebastian E. Reyes-Lillo and Dimitri Antoniadis and Jayakanth Ravichandran and Stefan Slesazeck and Thomas Mikolajick and Asif Islam Khan},

url = {https://doi.org/10.1038/s41467-022-28860-1},

doi = {10.1038/s41467-022-28860-1},

year  = {2022},

date = {2022-03-01},

journal = {Nature Communications},

volume = {13},

number = {1},

publisher = {Springer Science and Business Media LLC},

keywords = {},

pubstate = {published},

tppubtype = {article}

}

@article{Tan2022,

title = {Full-Space Potential Gradient Driven Charge Migration inside BiFeO$łess$sub$greater$3$łess$/sub$greater$ Photocathode},

author = {Bing Tan and Abdul M. Reyes and Eduardo Menéndez-Proupin and Sebastian E. Reyes-Lillo and Yanbo Li and Zemin Zhang},

url = {https://doi.org/10.1021/acsenergylett.2c01750},

doi = {10.1021/acsenergylett.2c01750},

year  = {2022},

date = {2022-09-01},

journal = {ACS Energy Letters},

pages = {3492--3499},

publisher = {American Chemical Society (ACS)},

keywords = {},

pubstate = {published},

tppubtype = {article}

}