bump dpdata version to 0.2.4 (#595)

* bump dpdata version to 0.2.4

* fix AssertionErrors in TestPostGaussian (#5)

* fix bug issue:597 (#598) (#6)

* fix bug issue:597

* fix energies mismatch bug for dpdata cp2k unittest

* fix issue 597

Co-authored-by: Yongbin Zhuang <38876805+robinzyb@users.noreply.github.com>

Co-authored-by: Han Wang <wang_han@iapcm.ac.cn>
Co-authored-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
Co-authored-by: Han Wang <amcadmus@gmail.com>
Co-authored-by: Yongbin Zhuang <38876805+robinzyb@users.noreply.github.com>

Author: 5 people

setup.py

@@ -17,7 +17,7 @@
 with open(path.join('dpgen', '_date.py'), 'w') as fp :
     fp.write('date = \'%s\'' % today)
 
-install_requires=['numpy>=1.14.3', 'dpdata>=0.1.14', 'pymatgen>=2019.1.13', 'ase', 'monty>2.0.0', 'paramiko', 'custodian','GromacsWrapper>=0.8.0', 'dpdispatcher>=0.3.11']
+install_requires=['numpy>=1.14.3', 'dpdata>=0.2.4', 'pymatgen>=2019.1.13', 'ase', 'monty>2.0.0', 'paramiko', 'custodian','GromacsWrapper>=0.8.0', 'dpdispatcher>=0.3.11']
 
 setuptools.setup(
     name=NAME,

tests/generator/out_data_post_fp_gaussian/orig/energy.raw

@@ -1 +1 @@
--1102.7145808882785
+-1102.7145898692427