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The Journal of Physical Chemistry. A|December 29, 2022
A Comparative Study on the Combustion Chemistry of Two Bio-hybrid Fuels: 1,3-Dioxane and 1,3-DioxolaneMaximilian Hellmuth, Bingjie Chen, Chaimae Bariki, et al.
Journal of Chemical Theory and Computation|July 25, 2017
Round Robin Study: Molecular Simulation of Thermodynamic Properties from Models with Internal Degrees of FreedomMichael Schappals, Andreas Mecklenfeld, Leif Kröger, et al.
The Journal of Chemical Physics|January 8, 2018
The furan microsolvation blind challenge for quantum chemical methods: First stepsHannes C Gottschalk, Anja Poblotzki, Martin A Suhm, et al.
The Journal of Chemical Physics|May 3, 2020
The first microsolvation step for furans: New experiments and benchmarking strategiesHannes C Gottschalk, Anja Poblotzki, Mariyam Fatima, et al.
Physical Chemistry Chemical Physics : PCCP|August 23, 2023
The first HyDRA challenge for computational vibrational spectroscopyTaija L Fischer, Margarethe Bödecker, Sophie M Schweer, et al.
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