Roads to pentazolate anion: a theoretical insight

Stabilization of the Pentazolate Anion in a Zeolitic Architecture with Na20 N60 and Na24 N60 Nanocages

(2018) Wenquan Zhang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Stabilization of the Pentazolate Anion in Three Anhydrous and Metal-Free Energetic Salts

(2018) Yuangang Xu et al.   Chemistry-An Asian Journal

High-Pressure Synthesized Lithium Pentazolate Compound Metastable under Ambient Conditions

(2018) D. Laniel et al.   Journal of Physical Chemistry Letters

Synthesis of AgN5 and its extended 3D energetic framework

(2018) Chengguo Sun et al.   Nature Communications

A series of energetic metal pentazolate hydrates

(2017) Yuangang Xu et al.   NATURE

Synthesis and characterization of the pentazolate anioncyclo-N5ˉ in (N5)6(H3O)3(NH4)4Cl

(2017) Chong Zhang et al.   SCIENCE

Detection of Cyclo-N5 − in THF Solution

(2016) Boris Bazanov et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Cover Picture: A Metallaanthracene and Derived Metallaanthraquinone (Angew. Chem. Int. Ed. 1/2017)

(2016) Benjamin J. Frogley et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

High-Pressure Synthesis of a Pentazolate Salt

(2016) Brad A. Steele et al.   CHEMISTRY OF MATERIALS

Preparation of the Cyclopentazole Anion in the Bulk: A Computational Study

(2016) Uzi Geiger et al.   JOURNAL OF PHYSICAL CHEMISTRY B

4-Oxo- or 1-oxo-N7O+? A computational and experimental study

(2014) Tao Yu et al.   RSC Advances

The ORCA program system

(2011) Frank Neese   Wiley Interdisciplinary Reviews-Computational Molecular Science

Kinetic Stability and Propellant Performance of Green Energetic Materials

(2010) Martin Rahm et al.   CHEMISTRY-A EUROPEAN JOURNAL

Synthesis and Properties of N7O+

(2010) Karl O. Christe et al.   INORGANIC CHEMISTRY

Continuous surface charge polarizable continuum models of solvation. I. General formalism

(2010) Giovanni Scalmani et al.   JOURNAL OF CHEMICAL PHYSICS

Minimally augmented Karlsruhe basis sets

(2010) Jingjing Zheng et al.   THEORETICAL CHEMISTRY ACCOUNTS

Correlation analysis of the interconversion and nitrogen loss reactions of aryl pentazenes and pentazoles derived from aryl diazonium and azide ions

(2009) Luke A. Burke et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

First Calculations of15N−15NJValues and New Calculations of Chemical Shifts for High Nitrogen Systems: A Comment on the Long Search for HN5and Its Pentazole Anion

(2009) S. Ajith Perera et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data

(2009) Alexandre Tkatchenko et al.   PHYSICAL REVIEW LETTERS

A Ceric Ammonium Nitrate N-Dearylation ofN-p-Anisylazoles Applied to Pyrazole, Triazole, Tetrazole, and Pentazole Rings:  Release of Parent Azoles. Generation of Unstable Pentazole, HN5/N5-, in Solution

(2008) Richard N. Butler et al.   JOURNAL OF ORGANIC CHEMISTRY

Double-Hybrid Functionals for Thermochemical Kinetics

(2007) Alex Tarnopolsky et al.   JOURNAL OF PHYSICAL CHEMISTRY A