Niraj Nepal

Poznan Supercomputing and Networking Center

United States

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Articles (9)

Year:

2024

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2024

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2024

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2021

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2021

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2020

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2020

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2020

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2020

Collaborators (2)

Santosh Neupane

Assistant Professor of Physics

Alvernia University

UNITED STATES

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Biswajit Santra

Research Assistant Professor

Temple University

UNITED STATES

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Niraj Nepal

Research Interests

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Articles (9)

HTESP (High-throughput electronic structure package): A package for high-throughput ab initio calculations

First-order structural phase transition at low temperature in GaPt5P and its rapid enhancement with pressure

Imaginary phonon modes and phonon-mediated superconductivity in Y2C3

Describing adsorption of benzene, thiophene, and xenon on coinage metals by using the Zaremba–Kohn theory-based model

Interpretations of ground-state symmetry breaking and strong correlation in wavefunction and density functional theories

The Fermi–Löwdin self-interaction correction for ionization energies of organic molecules

Understanding plasmon dispersion in nearly free electron metals: Relevance of exact constraints for exchange-correlation kernels within time-dependent density functional theory

Formation energy puzzle in intermetallic alloys: Random phase approximation fails to predict accurate formation energies

Constraint-based wave vector and frequency dependent exchange-correlation kernel of the uniform electron gas

Collaborators (2)

Santosh Neupane

Biswajit Santra

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