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Data for: Catalytic Decomposition Mechanism of Aqueous Ammonium Dinitramide Solution Elucidated by Thermal and Spectroscopic Methods

NIAID Data Ecosystem2026-03-13 收录

含能材料分解

热分析-光谱联用技术

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https://data.mendeley.com/datasets/pxwwwd97cm 数据链接链接失效反馈

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资源简介：

Raw TG-DTA data and TG-FTIR data is submitted

应用场景：

创建时间：

2022-07-21

含能材料分解

分子动力学模拟

Effects of molecular vacancies on the decomposition mechanisms and reaction dynamics of condensed-phase β-HMX at various temperatures were studied using ReaxFF molecular dynamics simulations. Results

NIAID Data Ecosystem30

Nitromethane Decomposition via Automated Reaction Discovery and an Ab Initio Corrected Kinetic Model

反应动力学

含能材料分解

We explore the systematic construction of kinetic models from in silico reaction data for the decomposition of nitromethane. Our models are constructed in a computationally affordable manner by using

NIAID Data Ecosystem20

RDX Geometries, Excited States, and Revised Energy Ordering of Conformers via MP2 and CCSD(T) Methodologies: Insights into Decomposition Mechanism

含能材料分解

量子化学计算

The geometries, harmonic frequencies, elec-tronic excitation levels, and energetic orderings of various conformers of RDX have been computed at the ab initio MP2 and CCSD(T) levels, providing more rel

NIAID Data Ecosystem20

Accelerated Decomposition Kinetics of Ammonium Perchlorate via Conformal Graphene Coating

含能材料分解

涂层技术

Ammonium perchlorate (AP) is an oxidizer material that is widely employed in applications ranging from rocketry to airbags. Previous research has suggested that efficient electron transfer plays a cri

DataCite Commons2024-02-26 更新30

Data for: Catalytic Decomposition Mechanism of Aqueous Ammonium Dinitramide Solution Elucidated by Thermal and Spectroscopic Methods

含能材料分解

热分析-光谱联用

Raw TG-DTA data and TG-FTIR data is submitted

Mendeley Data20