Bobby G Sumpter
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Explore the profile of Bobby G Sumpter including associated specialties, affiliations and a list of published articles.
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225
Citations
1746
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Recent Articles
1.
Tung C, Ding L, Chang M, Huang G, Porcar L, Wang Y, et al.
J Chem Phys
. 2025 Feb;
162(7).
PMID: 39968816
Small-angle scattering techniques are indispensable tools for probing the structure of soft materials. However, traditional analytical models often face limitations in structural inversion for complex systems, primarily due to the...
2.
Jakowski J, Lu W, Briggs E, Lingerfelt D, Sumpter B, Ganesh P, et al.
J Chem Theory Comput
. 2025 Jan;
21(3):1322-1339.
PMID: 39848252
We present the theory, implementation, and benchmarking of a real-time time-dependent density functional theory (RT-TDDFT) module within the RMG code, designed to simulate the electronic response of molecular systems to...
3.
Tung C, Ding L, Huang G, Wang Y, Carrillo J, Sumpter B, et al.
J Chem Phys
. 2024 Dec;
161(22).
PMID: 39651823
In this study, we present a novel orientation discretization approach based on the rhombic triacontahedron for Monte Carlo simulations of semiflexible polymer chains, aiming at enhancing structural analysis through rheo-small-angle...
4.
Lu L, Huang J, Guerrero A, Street I, Mosali S, Sumpter B, et al.
ChemSusChem
. 2024 Dec;
18(5):e202401957.
PMID: 39639583
With energy shortages and excessive CO emissions driving climate change, converting CO into high-value-added products offers a promising solution for carbon recycling. We investigate CO reduction reactions (CORR) catalyzed by...
5.
Ding L, Tung C, Sumpter B, Chen W, Do C
J Chem Theory Comput
. 2024 Nov;
20(23):10697-10702.
PMID: 39569638
We develop off-lattice simulations of semiflexible polymer chains subjected to applied mechanical forces by using Markov Chain Monte Carlo. Our approach models the polymer as a chain of fixed length...
6.
Moon H, Carrillo J, Song M, Rim G, Heller W, Leisen J, et al.
ChemSusChem
. 2024 Jun;
17(22):e202400967.
PMID: 38830830
Solid-supported amines having low molecular weight branched poly(ethylenimine) (PEI) physically impregnated into porous solid supports are promising adsorbents for CO capture. Co-impregnating short-chain poly(ethylene glycol) (PEG) together with PEI alters...
7.
Scott H, Burns-Casamayor V, Dixson A, Standaert R, Stanley C, Stingaciu L, et al.
Biochim Biophys Acta Biomembr
. 2024 May;
1866(7):184349.
PMID: 38815687
Cell membranes are responsible for a range of biological processes that require interactions between lipids and proteins. While the effects of lipids on proteins are becoming better understood, our knowledge...
8.
Carrillo J, Parambil V, Patra T, Chen Z, Russell T, Sankaranarayanan S, et al.
J Phys Chem B
. 2024 Apr;
128(17):4220-4230.
PMID: 38648367
Star block copolymers (s-BCPs) have potential applications as novel surfactants or amphiphiles for emulsification, compatibilization, chemical transformations, and separations. s-BCPs have chain architectures where three or more linear diblock copolymer...
9.
Tung C, Chang S, Yip S, Wang Y, Carrillo J, Sumpter B, et al.
J Chem Phys
. 2024 Mar;
160(9).
PMID: 38445839
A method for characterizing the topological fluctuations in liquids is proposed. This approach exploits the concept of the weighted gyration tensor of a collection of particles and permits the definition...
10.
Kanbargi N, Damron J, Gao Y, Kearney L, Carrillo J, Keum J, et al.
ACS Macro Lett
. 2024 Feb;
13(3):280-287.
PMID: 38346266
We present a streamlined method to covalently bond hydroxylated carbon nanotubes (CNOH) within a polyphenol matrix, all achieved through a direct, solvent-free process. Employing an extremely small concentration of CNOH...