Theoretical studies on high energetic density nitramine explosives containing pyridine

来源 :中国科学：化学英文版 | 被引量 : 0次 | 上传用户：cstmddn

【摘要】

：

包含 pyridine 的炸药的感觉迟钝的性质与 nitramine 炸药的高精力被相结合，并且包含 pyridine 的新 nitramine 炸药的概念被建议进进哪个 nitramine，有 N-N 契约的组被介绍像

【作者】

：

ZHAO GuoZheng LU Ming

【机构】

：

SchoolofChemicalEngineering

【出处】

：

中国科学：化学英文版

【发表日期】

：

2012年9期

【关键词】

：

高能量密度化合物硝胺炸药吡啶分子结构密度泛函理论爆轰性能分子设计 RDX density functional theory （DFT） nitr

【基金项目】

：

This work was supported by the NSAF Foundation of National Natural Science Foundation of China and China Academy of Engineering Physics （ 11076017）.

下载到本地 , 更方便阅读

下载此文赞助VIP

声明 : 本文档内容版权归属内容提供方 , 如果您对本文有版权争议 , 可与客服联系进行内容授权或下架

论文部分内容阅读

包含 pyridine 的炸药的感觉迟钝的性质与 nitramine 炸药的高精力被相结合，并且包含 pyridine 的新 nitramine 炸药的概念被建议进进哪个 nitramine，有 N-N 契约的组被介绍像一样可能。基于包含 pyridine 的 nitramine 混合物的分子的结构，密度功能的理论(DFT ) 计算方法被使用在 B3LYP/631+G (d) 学习设计分子水平。几何、电子的结构，密度，形成(HOF ) 的热，爆炸表演和契约分离精力(BDE ) 被调查并且比得上 1,3,5

其他文献

Mechanism and kinetics of 2-chlorophenol decomposition using coupled ultrasound and electrocatalysis

A coupled ultrasound/electrocatalysis(US/EC) process was used to enhance the decomposition effi-ciency of organics.The synergetic kinetics and the mechanism of

期刊

ultrasound/electrocatalysissynergeticoxidationMECHANISMKINETICS2-CHLOROPHEN

Toxicity of graphene oxide and multi-walled carbon nanotubes against human cells and zebrafish

Graphene 拥有唯一的物理、化学的性质，它启发了大量潜在的生物医学的应用。然而，很少在人的身体和生态的环境上对 graphene 的不利效果被知道。我们的工作的目的是在 graphene

期刊

多壁碳纳米管毒性作用氧化石墨人体细胞斑马鱼生物医学应用神经母细胞瘤纳米材料graphene oxide multi-walled carbon

Methane and nitrous oxide concentration and emission flux of Yangtze Delta plain river net

Methane (CH4) and nitrous oxide (N2O) saturation concentration and gas-water interface emission flux in surface water of the Yangtze Delta plain river net were

期刊

plainriverNETCH4N2OCONCENTRATIONGAS-WATERinterfaceemissionFLUXplain ri

Analysis of local structure of Arg10 domain in apo-α- lactalbumin with a polarity-sensitive arginine

The polarity-sensitive fluorescent probe, 3-(4-chloro-6-p-glyoxalphenoxy-1,3,5-triazinylamino)-7- (dimethylamino)-2-methylphenazine, was used to analyze the loc

期刊

arginine-specificLABELINGFLUORESCENTprobeslocalpolaritydetectionconformat

Modular synthesis of a block copolymer with a cleavable linkage via “click” chemistry

A diblock copolymer poly(ethylene glycol)-block-polystyrene or PEG-b-PS with an olefinic double bond at the PEG and PS junction has been prepared by modular syn

期刊

MODULARsynthesiscleavableblockCOPOLYMERCLICKchemistryATRPmodular synthes

Theoretical study on the charge transport properties of triphenylene discogens with a phenylpropiony

Charge transport is one of the most important properties in organic materials.Charge transport properties of triphenylene discogens with a phenylpropionyloxy or

期刊

TRIPHENYLENECHARGEtransportDISCOTICLIQUIDCRYSTALSphenylpropilatephenylpro

Preparation and photochromism of Keggin-type molybdphosphoric acid/silica mesoporous composite thin

Using tetraethoxysilane and 3-aminopropyltriethoxysilane as the silica sources, amino-functionalized organic/inorganic hybrid mesoporous silica thin films with

期刊

molybdphosphoricACIDSILICAMESOPOROUScompositethinfilmsPREPARATIONPHOTOCH

Lamellar metal-organic complex and its rod-like nanoparticles prepared with ultrasonic technique

Metal-organic complex (H3NCH2CH2NH2)3[MoO2(OC6H4O)2] with a lamellar morphology has been syn- thesized. Its crystal structure was confirmed by single-crystal X-

期刊

METAL-ORGANICcomplexNANOPARTICLEULTRASONICtechniquemetal-organic complex na

‘Hierarchical self-assembly’ of helical amylose/SWNTs complex

Helical amylose/SWNTs complexes (A/S-C) of various sizes, a single nanotube wrapped by amylose in particular, were demonstrated. The formation process of the he

期刊

SELF-ASSEMBLYSWNTAMYLOSEHELICALhydrogenBONDINGself-assembly SWNT amylose h

Sorption characteristics and mechanisms of organic contaminant to carbonaceous biosorbents in aqueou

A series of carbonaceous biosorbents was prepared by pyrolyzing pine needles,a model biomass,at various temperatures (100-700℃) under an oxygen-limited conditi

期刊

CARBONACEOUSBIOSORBENTorganicCONTAMINANTPARTITIONadsorptionwastewatertrea

Theoretical studies on high energetic density nitramine explosives containing pyridine

其他学术论文