Category:Computational Physics

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Pages in category "Computational Physics"

The following 10 pages are in this category, out of 10 total.

A

Approximating Excited States using Neural Networks

C

Charged surfaces and slabs in periodic boundary conditions
Chemical Reactivity Studies by the Natural-Orbital-Functional 2nd-Order-Moller-Plesset (NOF-MP2) method. Water Dehydrogenation by the Scandium Cation

E

Efficient Gaussian Process Regression for prediction of molecular crystals harmonic free energies

I

In Vitro Electron Density Refinement from Solution X-ray Scattering in the Wide-Angle Regime

M

N

New Method for Simulating Photoprocesses in Astrochemical Models

O

On discontinuities when computing the stress-field from the strain: a finite volume discretization

P

Photoinduced Nonperturbative Valley Polarization in Graphene

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Physics

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