Concept
Chemical formula
Related publications (255)
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The present invention relates to a compound of the general formula (I), (II) and (III), more specifically of formula (Ia), (Ib), (Ic)wherein R11 and R12 or R21 and R22 or R31 and R32 are both hydrogen or form together with CHR50 a cyclic moiety or one of R ...
2024Biobased surfactant
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The present invention relates to a compound of the general formula (I), and (II)wherein one of R11 and R12 is hydrogen and the other is -CH2-R70, and one of R13 and R14 is hydrogen and the other is -CH2-R71, or wherein one of R11 and R12 is hydrogen and th ...
2024Investigation of mycelium film as the adhesive for poplar veneer bonding: insight into interfacial bonding mechanisms
The emergence of mycelium-bonded biocomposites has been stimulated in the quest for sustainable development. These biocomposites exhibit enhanced mechanical properties through hot pressing, with mycelium playing a crucial role as both the adhesive and rein ...
Abingdon2024Excited State-Specific CASSCF Theory for the Torsion of Ethylene
State-specific complete active space self-consistent field (SS-CASSCF) theory has emerged as a promising route to accurately predict electronically excited energy surfaces away from molecular equilibria. However, its accuracy and practicality for chemical ...
Amer Chemical Soc2024Modelling of metal alloys in realistic conditions with machine learning
Computer simulations based on statistical methods have emerged as a powerful tool for studying structure-property relationships at the atomistic level. However, to provide reliable insights into materials in realistic conditions, it is essential to accurat ...
EPFL2023Manning's Formula and the Strickler Scaling Derived from a Co-spectral Budget Model
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Manning's empirical formula in conjunction with Strickler's scaling is widely used to predict the bulk velocity (V) from the hydraulic radius (Rh), the roughness size (r), and the slope of the energy grade line (S) in uniform channel flows at high bulk Rey ...
2023A data-driven interpretation of the stability of organic molecular crystals
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Due to the subtle balance of intermolecular interactions that govern structure-property relations, predicting the stability of crystal structures formed from molecular building blocks is a highly non-trivial scientific problem. A particularly active and fr ...
ROYAL SOC CHEMISTRY2023