Cas van der Oord - Publications, H-index & Citations

Cas van der Oord

University of Cambridge

11H指数

22论文数

905被引数

收录论文 7

发表时间

Benchmarking of machine learning interatomic potentials for reactive hydrogen dynamics at metal surfaces

MACHINE LEARNING-SCIENCE AND TECHNOLOGY

IF4.6

2024-07-15

OAAI

Stark, Wojciech G.; van der Oord, Cas; Batatia, Ilyes; Zhang, Yaolong; Jiang, Bin; Csanyi, Gabor; Maurer, Reinhard J.

ACEpotentials.jl: A Julia implementation of the atomic cluster expansion Aceat势.jl: 原子簇扩展的Julia实现

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-10-23

OAAI

Witt, William C.; van der Oord, Cas; Gelzinyte, Elena; Jarvinen, Teemu; Ross, Andres; Darby, James P.; Ho, Cheuk Hin; Baldwin, William J.; Sachs, Matthias; Kermode, James; Bernstein, Noam; Csanyi, Gabor; Ortner, Christoph

Hyperactive learning for data-driven interatomic potentials 数据驱动的原子间势的超主动学习

NPJ COMPUTATIONAL MATERIALS

IF11.9

2023-09-13

OAAI

van der Oord, Cas; Sachs, Matthias; Kovacs, David Peter; Ortner, Christoph; Csanyi, Gabor

Atomic cluster expansion: Completeness, efficiency and stability

JOURNAL OF COMPUTATIONAL PHYSICS

IF3.8

2022-04-01

OAAI

Dusson, Genevieve; Bachmayr, Markus; Csanyi, Gabor; Drautz, Ralf; Etter, Simon; van der Oord, Cas; Ortner, Christoph

Linear Atomic Cluster Expansion Force Fields for Organic Molecules: Beyond RMSE

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2021-11-04

OAAI

Kovacs, David Peter; van der Oord, Cas; Kucera, Jiri; Allen, Alice E. A.; Cole, Daniel J.; Ortner, Christoph; Csanyi, Gabor

Performant implementation of the atomic cluster expansion (PACE) and application to copper and silicon 原子簇扩展 (PACE) 的高性能实现及其在铜和硅中的应用

NPJ COMPUTATIONAL MATERIALS

IF11.9

2021-06-28

126

OAAI

Lysogorskiy, Yury; Oord, Cas van der; Bochkarev, Anton; Menon, Sarath; Rinaldi, Matteo; Hammerschmidt, Thomas; Mrovec, Matous; Thompson, Aidan; Csanyi, Gabor; Ortner, Christoph; Drautz, Ralf

Regularised atomic body-ordered permutation-invariant polynomials for the construction of interatomic potentials

MACHINE LEARNING-SCIENCE AND TECHNOLOGY

IF4.6

2020-02-04

OAAI

van der Oord, Cas; Dusson, Genevieve; Csanyi, Gabor; Ortner, Christoph

研究方向