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List of works by Tao Yu

Adsorption behavior of acetone solvent at the HMX crystal faces: A molecular dynamics study.

scientific article

Balanced design for the feasible super rocket fuels: A first-principle study on gauche CHN7 and CHN3

scientific article published on 16 May 2018

Design and theoretical study of 15 novel high energy density compounds

scientific article published on 19 October 2014

Face-Dependent Solvent Adsorption: A Comparative Study on the Interfaces of HMX Crystal with Three Solvents.

scientific article published on 11 July 2017

Interactions of carbon nanotubes with the nitromethane-water mixture governing selective adsorption of energetic molecules from aqueous solution

scientific article published on 01 March 2015

Novel Energetic Coordination Polymers Based on 1,5-Di(nitramino)tetrazole With High Oxygen Content and Outstanding Properties: Syntheses, Crystal Structures, and Detonation Properties

scientific article published on 15 October 2019

Ordered and layered structure of liquid nitromethane within a graphene bilayer: toward stabilization of energetic materials through nanoscale confinement

scientific article published on 13 February 2015

Roads to pentazolate anion: a theoretical insight.

scientific article

Structural Rearrangement of Energetic Materials under an External Electric Field: A Case Study of Nitromethane.

scientific article published on 13 February 2018

Structural characteristics of liquid nitromethane at the nanoscale confinement in carbon nanotubes

scientific article published on 18 September 2014

Study on the computer-aided design of high energetic compounds based on the 1,2,3,4-tetrazine-1,3-dioxide frame.

scientific article published on 9 November 2017

Synthesis and Properties of Energetic Hydrazinium 5-Nitro-3-dinitromethyl-2H-pyrazole by Unexpected Isomerization of N-Nitropyrazole

scientific article published on 07 November 2019

Theoretical study of the effect of N-oxides on the performances of energetic compounds

scientific article published on 17 March 2016

Theoretical study on the structure and stability of [1,2,5] oxadiazolo [3,4-e] [1,2,3,4]-tetrazine-4,6-Di-N-dioxide (FTDO)

scientific article published on 01 July 2014

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