Evidence map›Paper›PMID 29214359›Full record

ArticleJournal of molecular modeling2017

Theoretical studies of the decomposition mechanisms of 1,2,4-butanetriol trinitrate.

Liguan Pei, Kehai Dong, Yanhui Tang, Bo Zhang, Chang Yu, Wenzuo Li

Abstract read
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In one paragraph

Article in Journal of molecular modeling, 2017. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 2 papers.

0numbers the graph read from it
0cells of the map it votes in
2citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

2 citing papers in PubMed.

  1. Article
  2. Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

6 authors.

Liguan PeiDepartment of Aircraft Engineering, Naval Aeronautical Engineering University, No. 188, Erma Road, Zhifu District, Yantai City, Shandong Province, 264001, China. peiliguan@sina.com.
Kehai DongDepartment of Aircraft Engineering, Naval Aeronautical Engineering University, No. 188, Erma Road, Zhifu District, Yantai City, Shandong Province, 264001, China.
Yanhui TangDepartment of Aircraft Engineering, Naval Aeronautical Engineering University, No. 188, Erma Road, Zhifu District, Yantai City, Shandong Province, 264001, China.
Bo ZhangDepartment of Aircraft Engineering, Naval Aeronautical Engineering University, No. 188, Erma Road, Zhifu District, Yantai City, Shandong Province, 264001, China.
Chang YuDepartment of Aircraft Engineering, Naval Aeronautical Engineering University, No. 188, Erma Road, Zhifu District, Yantai City, Shandong Province, 264001, China.
Wenzuo LiCollege of Chemistry and Chemical Engineering, Yantai University, Yantai, 264005, China.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Density functional theory (DFT) and canonical variational transition-state theory combined with a small-curvature tunneling correction (CVT/SCT) were used to explore the decomposition mechanisms of 1,2,4-butanetriol trinitrate (BTTN) in detail. The results showed that the γ-H abstraction reaction is the initial pathway for autocatalytic BTTN decomposition. The three possible hydrogen atom abstraction reactions are all exothermic. The rate constants for autocatalytic BTTN decomposition are 3 to 10

Indexed as

1,2,4-Butanetriol trinitrate (BTTN)Autocatalytic decompositionCanonical variational transition state theory (CVT)Density functional theory (DFT)Nitrate ester plasticized polyether (NEPE)

Identifiers

PMID29214359

What OpenQuestion holds

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Registered trials

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.