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quantum_package/INSTALL.md
Thomas Applencourt 7332f5c655 INPORTANT 
Add interface : output or interface : input in EZFIO.cfg
Update INSTALL.md
Clean ezfio_interface.py
2015-03-25 15:27:35 +01:00

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Installation

Requirements

  • curl
  • m4
  • GNU make
  • Fortran compiler (ifort or gfortran)
  • Python 2.7 or new
  • Bash

Installing <>

  1. Run ./setup_environment.sh It will doawnload and install all the requirement (Installing OCaml will take somme time 20min)

  2. source /home/razoa/quantum_package/quantum_package.rc It containt all the environement variable neeeded by the quantum package

  3. Create the Makefile.config who containt all the flag needed by the compilator. (cp ./src/Makefile.config.gfortran ./src/Makefile.config)

  4. make build It will compile all the fortran

Installing behind a firewall

  1. Download tsocks:

    wget http://sourceforge.net/projects/tsocks/files/latest/download mv download tsocks.tar.gz

  2. Tranfer tsocks.tar.gz on the remote host

  3. Configure tsocks with the proper directory for the tsocks.conf file:

    tar -zxvf tsocks.tar.gz cd tsocks-* ./configure –with-conf=${PWD}/tsocks.conf

  4. Create the tsocks.conf file with the following content:

    server = 127.0.0.1 server_port = 10000

  5. Create the tsocks library:

    make

  6. Add the libtsocks.so to the LD_PRELOAD environment variable:

    export LD_PRELOAD=“${PWD}/libtsocks.so.1.8”

  7. Create a custom curl command to set the tsocks option: open a file named curl, which is accessible from your PATH environment variable before the real curl command, and fill this file with:

    #!/bin/bash /usr/bin/curl –socks5 127.0.0.1:10000 $@

  8. Start a tsocks ssh tunnel:

    ssh -fN -D 10000 user@external-server.com