Deringer VL - Search Results

1

Fast Ionic Conductivity in the Most Lithium-Rich Phosphidosilicate Li₁₄SiP₆.

Strangmüller S, Eickhoff H, Müller D, Klein W, Raudaschl-Sieber G, Kirchhain H, Sedlmeier C, Baran V, Senyshyn A, Deringer VL, van Wüllen L, Gasteiger HA, Fässler TF. Strangmüller S, et al. Among authors: deringer vl. J Am Chem Soc. 2019 Sep 11;141(36):14200-14209. doi: 10.1021/jacs.9b05301. Epub 2019 Aug 27. J Am Chem Soc. 2019. PMID: 31403777

2

Fast Lithium Ion Conduction in Lithium Phosphidoaluminates.

Restle TMF, Sedlmeier C, Kirchhain H, Klein W, Raudaschl-Sieber G, Deringer VL, van Wüllen L, Gasteiger HA, Fässler TF. Restle TMF, et al. Among authors: deringer vl. Angew Chem Int Ed Engl. 2020 Mar 27;59(14):5665-5674. doi: 10.1002/anie.201914613. Epub 2020 Jan 7. Angew Chem Int Ed Engl. 2020. PMID: 31825547 Free PMC article.

3

Supertetrahedral polyanionic network in the first lithium phosphidoindate Li₃InP₂ - structural similarity to Li₂SiP₂ and Li₂GeP₂ and dissimilarity to Li₃AlP₂ and Li₃GaP₂.

Restle TMF, Deringer VL, Meyer J, Raudaschl-Sieber G, Fässler TF. Restle TMF, et al. Among authors: deringer vl. Chem Sci. 2020 Nov 27;12(4):1278-1285. doi: 10.1039/d0sc05851c. Chem Sci. 2020. PMID: 34163890 Free PMC article.

4

Gaussian approximation potential modeling of lithium intercalation in carbon nanostructures.

Fujikake S, Deringer VL, Lee TH, Krynski M, Elliott SR, Csányi G. Fujikake S, et al. Among authors: deringer vl. J Chem Phys. 2018 Jun 28;148(24):241714. doi: 10.1063/1.5016317. J Chem Phys. 2018. PMID: 29960342 Free article.

5

Reactivity of Amorphous Carbon Surfaces: Rationalizing the Role of Structural Motifs in Functionalization Using Machine Learning.

Caro MA, Aarva A, Deringer VL, Csányi G, Laurila T. Caro MA, et al. Among authors: deringer vl. Chem Mater. 2018 Nov 13;30(21):7446-7455. doi: 10.1021/acs.chemmater.8b03353. Epub 2018 Sep 10. Chem Mater. 2018. PMID: 30487663 Free PMC article.

6

High-pressure synthesis and characterization of Li2Ca3[N2]3--an uncommon metallic diazenide with [N2]2- ions.

Schneider SB, Seibald M, Deringer VL, Stoffel RP, Frankovsky R, Friederichs GM, Laqua H, Duppel V, Jeschke G, Dronskowski R, Schnick W. Schneider SB, et al. Among authors: deringer vl. J Am Chem Soc. 2013 Nov 6;135(44):16668-79. doi: 10.1021/ja408816t. J Am Chem Soc. 2013. PMID: 24090235

7

Towards an atomistic understanding of disordered carbon electrode materials.

Deringer VL , Merlet C , Hu Y , Lee TH , Kattirtzi JA , Pecher O , Csányi G , Elliott SR , Grey CP . Deringer VL , et al. Chem Commun (Camb). 2018 Jun 8;54(47):5988-5991. doi: 10.1039/c8cc01388h. Chem Commun (Camb). 2018. PMID: 29790508 Free PMC article.

8

Mapping Materials and Molecules.

Cheng B, Griffiths RR, Wengert S, Kunkel C, Stenczel T, Zhu B, Deringer VL, Bernstein N, Margraf JT, Reuter K, Csanyi G. Cheng B, et al. Among authors: deringer vl. Acc Chem Res. 2020 Sep 15;53(9):1981-1991. doi: 10.1021/acs.accounts.0c00403. Epub 2020 Aug 14. Acc Chem Res. 2020. PMID: 32794697

9

Machine-learned acceleration for molecular dynamics in CASTEP.

Stenczel TK, El-Machachi Z, Liepuoniute G, Morrow JD, Bartók AP, Probert MIJ, Csányi G, Deringer VL. Stenczel TK, et al. Among authors: deringer vl. J Chem Phys. 2023 Jul 28;159(4):044803. doi: 10.1063/5.0155621. J Chem Phys. 2023. PMID: 37497818

10

An accurate and transferable machine learning potential for carbon.

Rowe P, Deringer VL, Gasparotto P, Csányi G, Michaelides A. Rowe P, et al. Among authors: deringer vl. J Chem Phys. 2020 Jul 21;153(3):034702. doi: 10.1063/5.0005084. J Chem Phys. 2020. PMID: 32716159

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My NCBI Filters

Text availability

Article attribute

Article type

Publication date

79 results

Search Page