Arias TA - Search Results

1

Small-area population forecasting in a segregated city using density-functional fluctuation theory.

Chen Y, Kinkhabwala YA, Barron B, Hall M, Arias TA, Cohen I. Chen Y, et al. Among authors: arias ta. J Comput Soc Sci. 2024;7(3):2255-2275. doi: 10.1007/s42001-024-00305-3. Epub 2024 Aug 28. J Comput Soc Sci. 2024. PMID: 39524064 Free PMC article.

2

Density-functional fluctuation theory of crowds.

Méndez-Valderrama JF, Kinkhabwala YA, Silver J, Cohen I, Arias TA. Méndez-Valderrama JF, et al. Among authors: arias ta. Nat Commun. 2018 Aug 30;9(1):3538. doi: 10.1038/s41467-018-05750-z. Nat Commun. 2018. PMID: 30166535 Free PMC article.

3

Micrometer-sized electrically programmable shape-memory actuators for low-power microrobotics.

Liu Q, Wang W, Reynolds MF, Cao MC, Miskin MZ, Arias TA, Muller DA, McEuen PL, Cohen I. Liu Q, et al. Among authors: arias ta. Sci Robot. 2021 Mar 17;6(52):eabe6663. doi: 10.1126/scirobotics.abe6663. Sci Robot. 2021. PMID: 34043551

4

JDFTx: software for joint density-functional theory.

Sundararaman R, Letchworth-Weaver K, Schwarz KA, Gunceler D, Ozhabes Y, Arias TA. Sundararaman R, et al. Among authors: arias ta. SoftwareX. 2017;6:278-284. doi: 10.1016/j.softx.2017.10.006. Epub 2017 Nov 14. SoftwareX. 2017. PMID: 29892692 Free PMC article.

5

Classical density-functional theory of inhomogeneous water including explicit molecular structure and nonlinear dielectric response.

Lischner J, Arias TA. Lischner J, et al. Among authors: arias ta. J Phys Chem B. 2010 Feb 11;114(5):1946-53. doi: 10.1021/jp9012224. J Phys Chem B. 2010. PMID: 20085242

6

Joint density-functional theory: ab initio study of Cr2O3 surface chemistry in solution.

Petrosyan SA, Rigos AA, Arias TA. Petrosyan SA, et al. Among authors: arias ta. J Phys Chem B. 2005 Aug 18;109(32):15436-44. doi: 10.1021/jp044822k. J Phys Chem B. 2005. PMID: 16852958

7

Grand canonical electronic density-functional theory: Algorithms and applications to electrochemistry.

Sundararaman R, Goddard WA 3rd, Arias TA. Sundararaman R, et al. Among authors: arias ta. J Chem Phys. 2017 Mar 21;146(11):114104. doi: 10.1063/1.4978411. J Chem Phys. 2017. PMID: 28330356

8

A combined helium atom scattering and density-functional theory study of the Nb(100) surface oxide reconstruction: Phonon band structures and vibrational dynamics.

McMillan AA, Thompson CJ, Kelley MM, Graham JD, Arias TA, Sibener SJ. McMillan AA, et al. Among authors: arias ta. J Chem Phys. 2022 Mar 28;156(12):124702. doi: 10.1063/5.0085653. J Chem Phys. 2022. PMID: 35364873

9

Implicit solvation model for density-functional study of nanocrystal surfaces and reaction pathways.

Mathew K, Sundararaman R, Letchworth-Weaver K, Arias TA, Hennig RG. Mathew K, et al. Among authors: arias ta. J Chem Phys. 2014 Feb 28;140(8):084106. doi: 10.1063/1.4865107. J Chem Phys. 2014. PMID: 24588147

10

Kohn-Sham-like approach toward a classical density-functional theory of inhomogeneous polar molecular liquids: an application to liquid hydrogen chloride.

Lischner J, Arias TA. Lischner J, et al. Among authors: arias ta. Phys Rev Lett. 2008 Nov 21;101(21):216401. doi: 10.1103/PhysRevLett.101.216401. Epub 2008 Nov 19. Phys Rev Lett. 2008. PMID: 19113431

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