#!/bin/bash

JOB_NAME=VC-S

NUM_NODE=2
NUM_CPU=14
TOTAL_PROC=`expr $NUM_CPU \* $NUM_NODE`

TIME=05:00:00

#NODE_TYPE=s_core   #MAX_CPU  1
#NODE_TYPE=q_core   #MAX_CPU  4
#NODE_TYPE=f_node   #MAX_CPU 28 MAX_NODE 2
NODE_TYPE=h_node   #MAX_CPU 14 
#NODE_TYPE=q_node   #MAX_CPU  7

MAIL_ADDR=tkamiya@msl.titech.ac.jp
#GROUP=tgd-mts 
GROUP=tga-kklab
BIN_DIR=/gs/hs0/tgd-mts/bin
MAIL_TYPE=abe

LOG=vasp.log

#BIN=vasp_ncl
#BIN=vasp_gpu
BIN=vasp_std

export VASPRunCMD="mpiexec.hydra -ppn \$NUM_CPU -n $TOTAL_PROC $BIN_DIR/$BIN"

#export QSubRunCMD="mpiexec.hydra -ppn \$NUM_CPU -n $TOTAL_PROC $BIN_DIR/$BIN"
export QSubRunCMD="$BaseDir/vasp_run_all.sh"