14 Oct 2024
Heya! Welcome@LatinXChemto our poster at #LatinXChem24. We are pleased to bring you all some of our findings around computational modelling of clusters to be applied in surface catalysis. Hope you find it exciting #LatinXChemComp #Comp175 #Zeolite #Catalysis #DFT @usponline.
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16 Oct 2023
Hi @LatinXChem, presenting my work ‘Adsorption of SDBS surfactant at air/water interface in presence of the beta-escin using MD simulations’ at #LatinXChemComp #Comp175 #LatinXChem23 @PCCP @ChemRxiv @ChemrxivComp, thank you to @facytuc_oficial @espol
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28 Nov 2022
Hi @LatinXChem, this is my work ‘Description of hydrogen bonds using polarized dipoles’, #LatinXChem22 #LXChemComp #Comp175
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20 Sep 2021
Hi @LatinXChem , this is my work ‘NNAIMQ: A Neural Network model for predicting QTAIM charges' Paving the way towards QTAIM based force-fields! #LatinXChem #LXChemComp #Comp175 #NN #QTAIM #DFT #QuantumChemistry #AtomicCharge
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