UNEP_v1 Family

2 datasets | 109K total configurations

Overview

Total Downloads

83

Total Configurations

109K

Unique Elements

16

Property Types

3

Methods Used

1

Software Packages

1

Elements Included

16 Elements
Ag Al Au Cr Cu Mg Mo Ni Pb Pd Pt Ta Ti V W Zr

Calculated Properties

3 Property Types
Energy (2 datasets) Atomic Forces (2 datasets) Cauchy Stress (2 datasets)

Methods

1 Methods
DFT-PBE

Software

1 Software
VASP

Member Datasets

2 Datasets
Dataset Name Downloads Configurations Elements Properties Links
UNEP_v1_2023_test
The test set for UNEP-v1 (version 1 of Unified NeuroEvolution Potential), a model implemented in GPUMD.
 39 4,411 16 3 View DOI
UNEP_v1_2023_train
The training set for UNEP-v1 (version 1 of Unified NeuroEvolution Potential), a model implemented in GPUMD.
 44 104,799 16 3 View DOI