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Danjo De Chavez
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On the electronic structure origin of mechanochemically induced selectivity in acid-catalyzed chitin hydrolysis
D De Chavez, H Kobayashi, A Fukuoka, J Hasegawa
The Journal of Physical Chemistry A 125 (1), 187-197, 2020
152020
Adsorption mediated tandem acid catalyzed cellulose hydrolysis by ortho-substituted benzoic acids
DP De Chavez, M Gao, H Kobayashi, A Fukuoka, J Hasegawa
Molecular Catalysis 475, 110459, 2019
82019
One-centre corrected two-electron integrals in inner projection-based integral evaluations
D De Chavez, R Lindh
Molecular Physics, e2228431, 2023
22023
Revisiting Activity Tuning Using Lattice Strain: CO Decomposition in Terrace Ru (0001) and Stepped Ru (1015) Surfaces
D De Chavez, J Hasegawa
The Journal of Physical Chemistry C 126 (22), 9324-9333, 2022
12022
OpenMechanochem: A Python module for mechanochemical simulations
D De Chavez, J Hasegawa
SoftwareX 16, 100879, 2021
12021
Theoretical Study on Mechanically Stressed Chemical Systems [an abstract of dissertation and a summary of dissertation review]
DP De Chavez
北海道大学, 2021
2021
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Articles 1–6