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- W2372074819 abstract "The paper uses computer molecular simulation technology and studies the Humul coal inertinite structure on the molecular scale.First,the molecular mechanics and annealing kinetics simulation achieves the 3 dimensional structure graphs.Molecular potential change is compared after the calculation;we find that Van Der Walls force is the main inter-molecular force.On the basis of quantum chemical calculation,the bond order,length and other structure parameters are further analyzed." @default.
- W2372074819 created "2016-06-24" @default.
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- W2372074819 date "2011-01-01" @default.
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- W2372074819 title "Molecular Simulation of Humul Coal Inertinite Structure Model" @default.
- W2372074819 hasPublicationYear "2011" @default.
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