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Anshuman Kumar
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Thermoelectric performance of an open-shell donor–acceptor conjugated polymer doped with a radical-containing small molecule
Y Joo, L Huang, N Eedugurala, AE London, A Kumar, BM Wong, ...
Macromolecules 51 (10), 3886-3894, 2018
552018
Covalent atomic bridges enable unidirectional enhancement of electronic transport in aligned carbon nanotubes
M Chen, W Li, A Kumar, G Li, ME Itkis, BM Wong, E Bekyarova
ACS applied materials & interfaces 11 (21), 19315-19323, 2019
292019
Linear polarizabilities and second hyperpolarizabilities of streptocyanines: Results from broken‐Symmetry DFT and new CCSD (T) benchmarks
L Xu, A Kumar, BM Wong
Journal of Computational Chemistry 39 (28), 2350-2359, 2018
252018
Harnessing deep neural networks to solve inverse problems in quantum dynamics: machine-learned predictions of time-dependent optimal control fields
X Wang, A Kumar, CR Shelton, BM Wong
Physical Chemistry Chemical Physics 22 (40), 22889-22899, 2020
222020
A new interpretation of the structure and solvent dependence of the far UV circular dichroism spectrum of short oligopeptides
A Kumar, R Schweitzer-Stenner, BM Wong
Chemical Communications 55 (40), 5701-5704, 2019
212019
Water-Mediated Electronic Structure of Oligopeptides Probed by Their UV Circular Dichroism, Absorption Spectra, and Time-Dependent DFT Calculations
A Kumar, SE Toal, D DiGuiseppi, R Schweitzer-Stenner, BM Wong
The Journal of Physical Chemistry B 124 (13), 2579-2590, 2020
172020
NIC-CAGE: An open-source software package for predicting optimal control fields in photo-excited chemical systems
A Raza, C Hong, X Wang, A Kumar, CR Shelton, BM Wong
Computer Physics Communications 258, 107541, 2021
152021
Efficient predictions of formation energies and convex hulls from density functional tight binding calculations
A Kumar, ZA Ali, BM Wong
Journal of Materials Science & Technology 141, 236-244, 2023
82023
GPU-Enhanced DFTB Metadynamics for Efficiently Predicting Free Energies of Biochemical Systems
A Kumar, PR Arantes, A Saha, G Palermo, BM Wong
Molecules 28 (3), 1277, 2023
62023
Linear-Response and Real-Time, Time-Dependent Density Functional Theory for Predicting Optoelectronic Properties of Dye-Sensitized Solar Cells
SI Allec, A Kumar, BM Wong
Dye-Sensitized Solar Cells, 171-201, 2019
22019
Accelerating quantum optimal control of multi-qubit systems with symmetry-based Hamiltonian transformations
X Wang, MS Okyay, A Kumar, BM Wong
AVS Quantum Science 5 (4), 2023
12023
Electron/Hole Mobilities of Periodic DNA and Nucleobase Structures from Large-Scale DFT Calculations
H Kwon, A Kumar, M Del Ben, BM Wong
The Journal of Physical Chemistry B, 2023
2023
Harnessing GPU-Enhanced Simulations for Efficient DFTB Metadynamics of Biochemical Systems
A Kumar, P Arantes, A Saha, G Palermo, B Wong
Bulletin of the American Physical Society, 2023
2023
Accelerating the Quantum Optimal Control of Large Qubit Systems with Symmetry-based Hamiltonian Transformations and Linear Unitary Propagators
X Wang, B Wong, A Kumar
Bulletin of the American Physical Society, 2023
2023
Harnessing Large-Scale Quantum Calculations for Predicting Material and Chemical Properties
A Kumar
UC Riverside, 2023
2023
Supplementary Information for “A New Interpretation of the Structure and Solvent Dependence of the Far UV Circular Dichroism Spectrum of Short Oligopeptides”
A Kumar, R Schweitzer-Stenner, BM Wong
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