Van Voorhis T - Search Results

1

Zhang C, Welborn M, Zhu T, Yang NJ, Santos MS, Van Voorhis T, Pentelute BL. Zhang C, et al. Among authors: van voorhis t. Nat Chem. 2016 Feb;8(2):120-8. doi: 10.1038/nchem.2413. Epub 2015 Dec 21. Nat Chem. 2016. PMID: 26791894 Free PMC article.

2

Error analysis of free probability approximations to the density of states of disordered systems.

Chen J, Hontz E, Moix J, Welborn M, Van Voorhis T, Suárez A, Movassagh R, Edelman A. Chen J, et al. Among authors: van voorhis t. Phys Rev Lett. 2012 Jul 20;109(3):036403. doi: 10.1103/PhysRevLett.109.036403. Epub 2012 Jul 17. Phys Rev Lett. 2012. PMID: 22861877 Free article.

3

A transferable model for singlet-fission kinetics.

Yost SR, Lee J, Wilson MW, Wu T, McMahon DP, Parkhurst RR, Thompson NJ, Congreve DN, Rao A, Johnson K, Sfeir MY, Bawendi MG, Swager TM, Friend RH, Baldo MA, Van Voorhis T. Yost SR, et al. Among authors: van voorhis t. Nat Chem. 2014 Jun;6(6):492-7. doi: 10.1038/nchem.1945. Epub 2014 May 4. Nat Chem. 2014. PMID: 24848234

4

Why many semiempirical molecular orbital theories fail for liquid water and how to fix them.

Welborn M, Chen J, Wang LP, Van Voorhis T. Welborn M, et al. Among authors: van voorhis t. J Comput Chem. 2015 May 5;36(12):934-9. doi: 10.1002/jcc.23887. Epub 2015 Mar 12. J Comput Chem. 2015. PMID: 25766721

5

Density matrix embedding in an antisymmetrized geminal power bath.

Tsuchimochi T, Welborn M, Van Voorhis T. Tsuchimochi T, et al. Among authors: van voorhis t. J Chem Phys. 2015 Jul 14;143(2):024107. doi: 10.1063/1.4926650. J Chem Phys. 2015. PMID: 26178090

6

Prediction of Excited-State Energies and Singlet-Triplet Gaps of Charge-Transfer States Using a Restricted Open-Shell Kohn-Sham Approach.

Hait D, Zhu T, McMahon DP, Van Voorhis T. Hait D, et al. Among authors: van voorhis t. J Chem Theory Comput. 2016 Jul 12;12(7):3353-9. doi: 10.1021/acs.jctc.6b00426. Epub 2016 Jun 20. J Chem Theory Comput. 2016. PMID: 27267803

7

Bootstrap embedding: An internally consistent fragment-based method.

Welborn M, Tsuchimochi T, Van Voorhis T. Welborn M, et al. Among authors: van voorhis t. J Chem Phys. 2016 Aug 21;145(7):074102. doi: 10.1063/1.4960986. J Chem Phys. 2016. PMID: 27544082

8

Salt Effect Accelerates Site-Selective Cysteine Bioconjugation.

Dai P, Zhang C, Welborn M, Shepherd JJ, Zhu T, Van Voorhis T, Pentelute BL. Dai P, et al. Among authors: van voorhis t. ACS Cent Sci. 2016 Sep 28;2(9):637-646. doi: 10.1021/acscentsci.6b00180. Epub 2016 Aug 25. ACS Cent Sci. 2016. PMID: 27725962 Free PMC article.

9

Long-range interactions from the many-pair expansion: A different avenue to dispersion in DFT.

de Silva P, Zhu T, Van Voorhis T. de Silva P, et al. Among authors: van voorhis t. J Chem Phys. 2017 Jan 14;146(2):024111. doi: 10.1063/1.4973728. J Chem Phys. 2017. PMID: 28088139

10

A structural and mechanistic study of π-clamp-mediated cysteine perfluoroarylation.

Dai P, Williams JK, Zhang C, Welborn M, Shepherd JJ, Zhu T, Van Voorhis T, Hong M, Pentelute BL. Dai P, et al. Among authors: van voorhis t. Sci Rep. 2017 Aug 11;7(1):7954. doi: 10.1038/s41598-017-08402-2. Sci Rep. 2017. PMID: 28801573 Free PMC article.

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