Interplay of thermochemistry and structural chemistry, the journal (volume 24, 2013, issues 3–4) and the discipline

Abstract

The contents of issues 3 and 4 for the calendar year 2013 are summarized in the current review of the journal Structural Chemistry. A brief thermochemical commentary is added to the summary of each paper. Abbreviations AIM Atoms in molecules BNNT Boron nitride nanotube CNC Carbon nanocone CSD Crystal structure determination DFT Density functional theory DNB 1,5-Dinitrobiuret EDA Energy decomposition analysis HF Hartree-Fock GED Gas electron diffraction GIAO Gauge-independent atomic orbital HOMA Harmonic oscillator measure of aromaticity MD Molecular dynamics MP Møller-Plesset perturbation MP2Second-order Møller-Plesset perturbation NRT Natural resonance theory ONIOM Our own N-layered integrated molecular orbital and molecular mechanics QTAIM Quantum theory of atoms-in-molecules NAO Natural atomic orbital NBO Natural bond orbital PES Potential energy surface

Interplay of thermochemistry and Structural Chemistry, the journal (Volume 26, 2015, Issues 1–2) and the discipline

“…Therefore, the structure of this review remains the same as that of its predecessors, and it follows the same conventions as the reviews for 2000 [2], 2001 [3], 2002 [4], 2003 [5], 2004 [6], 2005 [7], 2006 [8], 2007 [9], 2008 [10], 2009 [11], 2010 [12], 2011 (issues 1-3) [13], 2011 (issues 4-6) [14], 2012 (issues 1-3) [15], 2012 (issues 4-6) [16], 2013 (issues 1-2) [17], 2013 (issues 3-4) [18], 2013 (issues 5-6) [19], 2014 (issues 1-2) [20], 2014 (issues 3-4) [21], and 2014 (issues 5-6) [22]. All data for inorganic compounds with otherwise unreferenced enthalpies of formation are assumed from the ''Wagman compendium'' [23], and corresponding unreferenced enthalpies of formation of organic compounds are assumed from the ''Pedley compendium'' [24].…”

Interplay of thermochemistry and structural chemistry, the journal (volume 24, 2013, issues 5–6) and the discipline

“…In the present review, which is a conceptual successor of our earlier reviews [3][4][5][6][7][8][9][10][11][12][13][14][15][16][17][18][19], a brief content of each paper from issues 5 and 6 of 2013 volume, with the exception of errata is first presented. The attempts are then made to link the content of each paper with thermochemistry and also to suggest the fields of research that remained to be investigated.…”