Blum V - Search Results

1

Thermodynamic equilibrium conditions of graphene films on SiC.

Nemec L, Blum V, Rinke P, Scheffler M. Nemec L, et al. Among authors: blum v. Phys Rev Lett. 2013 Aug 9;111(6):065502. doi: 10.1103/PhysRevLett.111.065502. Epub 2013 Aug 6. Phys Rev Lett. 2013. PMID: 23971583

2

Thickness control of organic semiconductor-incorporated perovskites.

Park JY, Song R, Liang J, Jin L, Wang K, Li S, Shi E, Gao Y, Zeller M, Teat SJ, Guo P, Huang L, Zhao YS, Blum V, Dou L. Park JY, et al. Among authors: blum v. Nat Chem. 2023 Dec;15(12):1745-1753. doi: 10.1038/s41557-023-01311-0. Epub 2023 Aug 31. Nat Chem. 2023. PMID: 37653228

3

Exact constraints and appropriate norms in machine-learned exchange-correlation functionals.

Pokharel K, Furness JW, Yao Y, Blum V, Irons TJP, Teale AM, Sun J. Pokharel K, et al. Among authors: blum v. J Chem Phys. 2022 Nov 7;157(17):174106. doi: 10.1063/5.0111183. J Chem Phys. 2022. PMID: 36347690

4

Metal Halide Perovskite Heterostructures: Blocking Anion Diffusion with Single-Layer Graphene.

Hautzinger MP, Raulerson EK, Harvey SP, Liu T, Duke D, Qin X, Scheidt RA, Wieliczka BM, Phillips AJ, Graham KR, Blum V, Luther JM, Beard MC, Blackburn JL. Hautzinger MP, et al. Among authors: blum v. J Am Chem Soc. 2023 Feb 1;145(4):2052-2057. doi: 10.1021/jacs.2c12441. Epub 2023 Jan 17. J Am Chem Soc. 2023. PMID: 36649211 Free PMC article.

5

Unraveling the stability of polypeptide helices: critical role of van der Waals interactions.

Tkatchenko A, Rossi M, Blum V, Ireta J, Scheffler M. Tkatchenko A, et al. Among authors: blum v. Phys Rev Lett. 2011 Mar 18;106(11):118102. doi: 10.1103/PhysRevLett.106.118102. Epub 2011 Mar 16. Phys Rev Lett. 2011. PMID: 21469900

6

Impact of vibrational entropy on the stability of unsolvated peptide helices with increasing length.

Rossi M, Scheffler M, Blum V. Rossi M, et al. Among authors: blum v. J Phys Chem B. 2013 May 9;117(18):5574-84. doi: 10.1021/jp402087e. Epub 2013 Apr 29. J Phys Chem B. 2013. PMID: 23570562 Free article.

7

How cations change peptide structure.

Baldauf C, Pagel K, Warnke S, von Helden G, Koksch B, Blum V, Scheffler M. Baldauf C, et al. Among authors: blum v. Chemistry. 2013 Aug 19;19(34):11224-34. doi: 10.1002/chem.201204554. Epub 2013 Jul 12. Chemistry. 2013. PMID: 23853047

8

Validation challenge of density-functional theory for peptides-example of Ac-Phe-Ala5-LysH(+).

Rossi M, Chutia S, Scheffler M, Blum V. Rossi M, et al. Among authors: blum v. J Phys Chem A. 2014 Sep 4;118(35):7349-59. doi: 10.1021/jp412055r. Epub 2014 Jan 22. J Phys Chem A. 2014. PMID: 24405171

9

Native like helices in a specially designed β peptide in the gas phase.

Schubert F, Pagel K, Rossi M, Warnke S, Salwiczek M, Koksch B, von Helden G, Blum V, Baldauf C, Scheffler M. Schubert F, et al. Among authors: blum v. Phys Chem Chem Phys. 2015 Feb 21;17(7):5376-85. doi: 10.1039/c4cp05216a. Phys Chem Chem Phys. 2015. PMID: 25611682

10

Exploring the conformational preferences of 20-residue peptides in isolation: Ac-Ala19-Lys + H(+)vs. Ac-Lys-Ala19 + H(+) and the current reach of DFT.

Schubert F, Rossi M, Baldauf C, Pagel K, Warnke S, von Helden G, Filsinger F, Kupser P, Meijer G, Salwiczek M, Koksch B, Scheffler M, Blum V. Schubert F, et al. Among authors: blum v. Phys Chem Chem Phys. 2015 Mar 21;17(11):7373-85. doi: 10.1039/c4cp05541a. Phys Chem Chem Phys. 2015. PMID: 25700010

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