forked from lijiext/lammps
10 lines
434 B
Plaintext
10 lines
434 B
Plaintext
# DATE: 2020-01-31 UNITS: metal CONTRIBUTOR: Yunxing Zuo <y9zuo@eng.ucsd.edu> CITATION: Y. Zuo, C. Chen, X, Li, Z. Deng, Y. Chen, J. Behler, G. Csányi, A. V. Shapeev, A. P. Thompson, M. A. Wood, S. P. Ong, "Performance and Cost Assessment of Machine Learning Interatomic Potentials" J. Phys. Chem. A 124, 4, 731-745 (2020)
|
|
# Generated by Materials Virtual Lab
|
|
|
|
rcutfac 4.6
|
|
twojmax 6
|
|
rfac0 0.99363
|
|
rmin0 0
|
|
quadraticflag 0
|
|
bzeroflag 0
|