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Showing results 1 to 4 of 4

1
On the achievement of high fidelity and scalability for large-scale diagonalizations in grid-based DFT simulations

Choi, Sunghwan; Kim, Woo Youn; Yeom, Min Sun; Ryu, Hoon, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.118, no.16, 2018-08

2
Performance of heterogeneous computing with graphics processing unit and many integrated core for hartree potential calculations on a numerical grid

Choi, Sunghwan; Kwon, Oh Kyoung; Kim, Jaewook; Kim, Woo Youn, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.37, no.24, pp.2193 - 2201, 2016-09

3
Supersampling method for efficient grid-based electronic structure calculations

Ryu, Seongok; Choi, Sunghwan; Hong, Kwangwoo; Kim, Woo Youn, JOURNAL OF CHEMICAL PHYSICS, v.144, no.9, 2016-03

4
Update to ACE-molecule: Projector augmented wave method on lagrange-sinc basis set

Kang, Sungwoo; Ryu, Seongok; Choi, Sunghwan; Kim, Jaewook; Hong, Kwangwoo; Kim, Woo Youn, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.8, pp.644 - 650, 2016-04

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