Co-pyrolysis of subbituminous coal and lignin at isothermal and non-isothermal conditions: A ReaxFF molecular dynamics simulation

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Real-time Visualization, Engineering, Data Visualization +20

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Lignin, Lignin Chemistry, Chemistry +1

A Quantum Chemical View of Density Functional Theory

Evert Jan Baerends, O. V. Gritsenko · The Journal of Physical Chemistry A · 1997 · 628 citations

Engineering, Coulomb Holes, Computational Chemistry +16