def run_multi_vasp_without_job_from_file(job_name, job_list_file, node_name,
cpu_num, node_num, start_job_num,
par_job_num):
'''
Example:
pyvasp run_multi_vasp_without_job_from_file task job_list_file --node_name test_q --cpu_num 24
run multiple vasp task from job_list_file through test_q node whith 24 cpu
For more help you can refer to
https://pyvaspflow.readthedocs.io/zh_CN/latest/execute.html#run-multi-vasp-without-job-from-file
'''
job_list = np.loadtxt(job_list_file, dtype=int)
node_name, cpu_num = node_name.split(','), cpu_num.split(',')
if len(cpu_num) != len(node_name):
raise ValueError(
"The length of node_name is not consistent with the length of cpu_num"
)
rmvwj(job_name=job_name,
job_list=job_list,
node_name=node_name,
cpu_num=cpu_num,
node_num=node_num,
start_job_num=start_job_num,
par_job_num=par_job_num)
pid = os.getpid()
os.remove(
os.path.join(os.path.expanduser("~"), '.config', 'pyvaspflow',
str(pid)))
def run_multi_vasp_without_job(job_name,end_job_num,node_name,cpu_num,node_num,start_job_num,par_job_num):
'''
Example:
pyvasp run_multi_vasp_without_job task 5 --node_name test_q --cpu_num 24
run multiple vasp task from task0 to task5 through test_q node whith 24 cpu
For more help you can refer to
https://pyvaspflow.readthedocs.io/zh_CN/latest/execute.html#run-multi-vasp-without-job
'''
node_name,cpu_num = node_name.split(','),cpu_num.split(',')
if len(cpu_num) != len(node_name):
raise ValueError("The length of node_name is not consistent with the length of cpu_num")
rmvwj(job_name=job_name,end_job_num=end_job_num,node_name=node_name,cpu_num=cpu_num,
node_num=node_num,start_job_num=start_job_num,par_job_num=par_job_num)