scholarly article | Q13442814 |
P356 | DOI | 10.1039/C7CP00735C |
P698 | PubMed publication ID | 28537281 |
P50 | author | Peter Schwerdtfeger | Q7176827 |
P2093 | author name string | Andreas Hansen | |
Rebecca Sure | |||
Stefan Grimme | |||
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The C60 formation puzzle "solved": QM/MD simulations reveal the shrinking hot giant road of the dynamic fullerene self-assembly mechanism | Q33342958 | ||
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Parametrization and Benchmark of DFTB3 for Organic Molecules | Q40295934 | ||
Co-C Bond Dissociation Energies in Cobalamin Derivatives and Dispersion Effects: Anomaly or Just Challenging? | Q40309276 | ||
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Competition between Even and Odd Fullerenes: C118, C119, and C120 | Q58279269 | ||
Pentagon adjacency as a determinant of fullerene stability | Q58279341 | ||
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P433 | issue | 22 | |
P407 | language of work or name | English | Q1860 |
P304 | page(s) | 14296-14305 | |
P577 | publication date | 2017-05-24 | |
P1433 | published in | Physical Chemistry Chemical Physics | Q3018671 |
P1476 | title | Comprehensive theoretical study of all 1812 C60 isomers | |
P478 | volume | 19 |
Q47565726 | A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions |
Q46313384 | Automated and efficient quantum chemical determination and energetic ranking of molecular protonation sites |
Q92933832 | Toward Understanding the Isomeric Stability of Fullerenes with Density Functional Theory and the Information-Theoretic Approach |
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