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20132025
most citedImplementation of van der Waals Density Functional Approach to the Spin-Polarized System: Interaction Potential between Oxygen Molecules

19 citations · 76 across the 10 of their papers we have counts for

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physics.comp-ph2025

Efficient implementation of the quasiparticle self-consistent method on GPU

Masao Obata, Takao Kotani, Tatsuki Oda

We have developed a multi-GPU version of the quasiparticle self-consistent (QSGW), a cutting-edge method for describing electronic excitations in a first-principles approach.…

physics.comp-ph2015★ 16 cited

Improving the Description of Nonmagnetic and Magnetic Molecular Crystals via the van der Waals Density Functional

Masao Obata, Makoto Nakamura, Ikutaro Hamada +1

We have derived and implemented a stress tensor formulation for the van derWaals density functional (vdW-DF) with spin-polarization-dependent gradient correction (GC) recently prop…