Valeria Bonilla 🇨🇴 (@Val_BonillaGo) - Twitter 프로필

고정된 트윗

Hey @LatinXChem! I present to you my poster for #LatinXChem22. Even though organic solar cells are awesome and could significantly contribute to environmental remediation, many haven't even heard about them. So let's change that :) #LXChemComp #Comp185 #LatinXChem #UNAL

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Valeria Bonilla 🇨🇴 리트윗함

PCCP@PCCP·4 May

HOT and free to access now: 2023 PCCP HOT Articles. Read them here: rsc.li/pccp-hot23

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Valeria Bonilla 🇨🇴 리트윗함

PCCP@PCCP·9 Oca

Meet the winners of the #LatinXChem22 poster prizes for #LXChemPhys and #LXChemComp - read the full article on our blog! 🎉 @LatinXChem blogs.rsc.org/cp/2023/01/09/…

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Valeria Bonilla 🇨🇴@Val_BonillaGo·11 Ara

@ACOjedaP @UNALOficial @MincienciasCo Muchas gracias por tu mensaje @ACOjedaP! Muy feliz de poder dar a conocer algo de la investigación que se desarrolla en Colombia y en la Universidad Nacional ❤️

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Valeria Bonilla 🇨🇴@Val_BonillaGo·9 Ara

@SuntheticsML @LatinXChem @UNALOficial Thank you so much @SuntheticsML! Would be incredible to work with you, there is still so much to explore on this topics and so much to learn. ✨

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Sunthetics@SuntheticsML·6 Ara

@LatinXChem @Val_BonillaGo @UNALOficial Congratulations Valeria! (@Val_BonillaGo) We look forward at working together and exploring how ML can speed up your research!

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LatinXChem@LatinXChem·6 Ara

The organizers and judges of the #LXChemComp category with @SuntheticsML, award the second best poster to @Val_BonillaGo of @UNALOficial for her poster entitled "Energy transfer in light-harvesting macromolecules"

Valeria Bonilla 🇨🇴@Val_BonillaGo

Hey @LatinXChem! I present to you my poster for #LatinXChem22. Even though organic solar cells are awesome and could significantly contribute to environmental remediation, many haven't even heard about them. So let's change that :) #LXChemComp #Comp185 #LatinXChem #UNAL

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Valeria Bonilla 🇨🇴@Val_BonillaGo·29 Kas

@RCrespoOtero @LatinXChem Once all the conformations were excited, we proceeded with the NExMD for a total of 100 fs, with a constant energy ensemble, and calculated the transition density matrix every 0.1 fs.

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Rachel Crespo-Otero@RCrespoOtero·29 Kas

@Val_BonillaGo @LatinXChem Very nice work @Val_BonillaGo! Could you provide more details about the simulations? What was the method used? How did you get the nuclear dynamics? How did you get the electronic states? Thanks Rachel

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Valeria Bonilla 🇨🇴@Val_BonillaGo·28 Kas

Hey @LatinXChem! I present to you my poster for #LatinXChem22. Even though organic solar cells are awesome and could significantly contribute to environmental remediation, many haven't even heard about them. So let's change that :) #LXChemComp #Comp185 #LatinXChem #UNAL

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Valeria Bonilla 🇨🇴@Val_BonillaGo·29 Kas

@RCrespoOtero @LatinXChem A sample of 350 conformations of each system was excited with a simulated laser pulse according to a Franck-Condon window centered around 390 nm. The wavelength was chosen to match experimental data previously measured by other authors.

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Valeria Bonilla 🇨🇴@Val_BonillaGo·29 Kas

@RCrespoOtero @LatinXChem Hello, Rachel! We used a semiclassical approach, with the atoms represented by a classical potential, while electrons were treated with AM1 semiempirical Hamiltonian. To perform all this, we used the NEXMD software package, created by Los Alamos National Laboratory

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Valeria Bonilla 🇨🇴@Val_BonillaGo·28 Kas

@FlorentLouis59 @AldoZarbin @LatinXChem This category is just right for my research. I have been working with non-adiabatic molecular dynamics to study organic macromolecules with photovoltaic applications. #LXChemEnv

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Florent LOUIS, FRSC@FlorentLouis59·10 Kas

@AldoZarbin @LatinXChem #LXChemComp and #LXChemPhys Missing a category #LXChemEnv for environnemental chemistry with molecular simulations together with experiments

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