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Interplay of thermochemistry and Structural Chemistry, the journal (volume 22, 2011, issues 4–6) and the discipline

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Abstract

In the current review of the journal Structural Chemistry, the content of the issues 4–6 for the calendar year 2011 is related to thermochemistry. To the summary of each paper, a brief thermochemical commentary is added.

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Abbreviations

1D:

One-dimensional

2D:

Two-dimensional

3D:

Three-dimensional

AIM:

Atoms in molecules

DFT:

Density functional theory

EDA:

Energy decomposition analysis

MD:

Molecular dynamics

MO:

Molecular orbital

NBO:

Natural bond orbital

QSAR:

Quantitative structure–activity relationship

QSPR:

Quantitative structure–property relationship

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Correspondence to Maja Ponikvar-Svet or Joel F. Liebman.

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Ponikvar-Svet, M., Zeiger, D.N. & Liebman, J.F. Interplay of thermochemistry and Structural Chemistry, the journal (volume 22, 2011, issues 4–6) and the discipline. Struct Chem 23, 1267–1280 (2012). https://doi.org/10.1007/s11224-012-0045-8

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