jwz-ecust

#! /bin/bash                        
#SBATCH --nodes=$${nodes}           
#SBATCH --ntasks=$${ntasks}                                       
#SBATCH --ntasks-per-node=$${ntasks_per_node}                      
#SBATCH --cpus-per-task=$${cpus_per_task}                          
#SBATCH --gres=$${gres}                                           
#SBATCH --qos=$${qos}                                            
#SBATCH --time=$${walltime}                                      
#SBATCH --partition=$${queue}                                     
#SBATCH --account=$${account}                                       

jwz-ecust

_fw_name: CommonAdapter
_fw_q_type: SLURM
rocket_launch: rlaunch -c /home/catml/atomate/config rapidfire
nodes: 1
ntasks: 48
walltime: '1680:00:00'
queue: null
account: null
job_name: null
pre_rocket: null

jwz-ecust

import matplotlib
matplotlib.use('Agg')
import matplotlib.pyplot as plt
from pymatgen.analysis.surface_analysis import WorkFunctionAnalyzer

plt.figure(figsize=(20, 15))


kwargs = {
    "poscar_filename": './CONTCAR',

jwz-ecust

import os
import sys
from glob import glob
from ase.io import read, write
from ase import Atoms
import numpy as np
from ase.utils import natural_cutoffs
from ase.build import molecule
import matplotlib.pyplot as plt

jwz-ecust

import os
import sys
from glob import glob
from ase.io import read, write
from ase import Atoms
import numpy as np
from ase.utils import natural_cutoffs
from ase.build import molecule
import matplotlib.pyplot as plt

jwz-ecust

import requests
import re

url = "http://muchong.com/bbs/logging.php?action=login"
sess = requests.session()

# 构建headers
headers = {
    'User-Agent': 'Mozilla/5.0 (Macintosh; Intel Mac OS X 10_12_6) \
        AppleWebKit/537.36 (KHTML, like Gecko) Chrome/60.0.3112.90 \

jwz-ecust

from collections import Counter
from collections import defaultdict

def solution(A):
    c = Counter(A)
    repeat = [i for i in c if c[i] > 1]
    ddict = defaultdict(list)
    for i in range(len(A)):
        ddict[A[i]].append(i)
    dis = [max(ddict[i]) -  min(ddict[i]) for i in ddict if len(ddict[i]) > 1]

jwz-ecust

class zjw():
    def __init__(self):
        self.name = 1

    @classmethod
    def classmethod(cls, arg):
        print dir(cls)
        print cls
        print dir(arg)
        print arg

jwz-ecust

import paramiko
import os


ssh = paramiko.SSHClient()
ssh.set_missing_host_key_policy(paramiko.AutoAddPolicy())
IP = "***********"
# port = 22
# user = "riic"
# key = "/Users/zhangjiawei/.ssh/id_dsa_138_jwzhang.jwzhang"

jwz-ecust

# -*- coding:utf-8 -*-
import re

IDCARD_REGEX = '[1-9][0-9]{14}([0-9]{2}[0-9X])?'
# 新身份证18位， 最后一位可能是X; 老身份证15位


def is_valid_idcard(idcard):
    """Validate id card is valid."""
    if isinstance(idcard, int):