Andres Henao Aristizabal

andres.henao.aristizabal@uni-paderborn.de
ID
67235

2 Publications

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[2]
2025 | Preprint | LibreCat-ID: 64071
Benchmarking semi-empirical quantum chemical methods on liquid water
X. Wu, H. Elgabarty, V. Alizadeh, A. Henao Aristizabal, F. Zysk, C. Plessl, S. Ehlert, J. Hutter, T.D. Kühne, (2025).
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[1]
2022 | Preprint | LibreCat-ID: 33678
On the Role of Hydrogen Bond Strength and Charge Transfer of a Diels-Alder Reaction On-Water: Semiempirical and Free Energy Calculations.
A. Henao Aristizabal, Y. Gohar, R. Whilhelm, T. Kühne, (2022).
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2 Publications

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[2]
2025 | Preprint | LibreCat-ID: 64071
Benchmarking semi-empirical quantum chemical methods on liquid water
X. Wu, H. Elgabarty, V. Alizadeh, A. Henao Aristizabal, F. Zysk, C. Plessl, S. Ehlert, J. Hutter, T.D. Kühne, (2025).
LibreCat | Download (ext.)
 
[1]
2022 | Preprint | LibreCat-ID: 33678
On the Role of Hydrogen Bond Strength and Charge Transfer of a Diels-Alder Reaction On-Water: Semiempirical and Free Energy Calculations.
A. Henao Aristizabal, Y. Gohar, R. Whilhelm, T. Kühne, (2022).
LibreCat
 
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