A yearly tradition of this Comp.Chem. lab and many others throughout our nation is to attend the Mexican Meeting on Theoretical Physical Chemistry to share news, progress and also a few drinks and laughs. This year the RMFQT was held in Puebla and although unfortunately I was not able to attend this lab was proudly represented by its current members. Gustavo Mondragón gave a talk about his progress on his photosynthesis research linking to the previous work of María Eugenia Sandoval already presented in previous editions; kudos to Gustavo for performing remarkably and thanks to all those who gave us their valuable feedback and criticism. Also, five posters were presented successfully, I can only thank the entire team for representing our laboratory in such an admirable way, and a special mention to the junior members, I hope this was the first of many scientific events they attend and may you deeply enjoy each one of them.
Among the invited speakers, the RMFQT had the honor to welcome Prof. John Perdew (yes, the P in PBE); the team took the opportunity of getting a lovely picture with him.
Here is the official presentation of the newest members of our group:
Alejandra Barrera (hyperpolarizabilty calculations on hypothetical poly-calyx[n]arenes for the search of NLO materials)
Fernando Uribe (Interaction energy calculations for non-canonical nucleotides)
Juan Guzmán (Reaction mechanisms calculations for catalyzed organic reactions)
We thank the organizing committee for giving us the opportunity to actively participate in this edition of the RMFQT, we eagerly await for next year as every year.
felicidades doctor espero se encuentre bien saludos perdón, una pregunta en que sofware o paquete de computo realizan sus simulaciones saludos espero no molestarle El miércoles, 29 de noviembre de 2017 09:02:53 GMT-6, Dr. Joaquin Barroso’s Blog escribió: #yiv8979587753 a:hover {color:red;}#yiv8979587753 a {text-decoration:none;color:#0088cc;}#yiv8979587753 a.yiv8979587753primaryactionlink:link, #yiv8979587753 a.yiv8979587753primaryactionlink:visited {background-color:#2585B2;color:#fff;}#yiv8979587753 a.yiv8979587753primaryactionlink:hover, #yiv8979587753 a.yiv8979587753primaryactionlink:active {background-color:#11729E;color:#fff;}#yiv8979587753 WordPress.com | joaquinbarroso posted: “A yearly tradition of this Comp.Chem. lab and many others throughout our nation is to attend the Mexican Meeting on Theoretical Physical Chemistry to share news, progress and also a few drinks and laughs. This year the RMFQT was held in Puebla and althoug” | |
Gracias Juan!
En general Gaussian 09 y 16; para lo de ADN y fotosíntesis usamos QChem. Los renders con GaussView, QuteMol y Chimera.
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