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vijay gopal chilkuri 2016-12-20 12:23:07 +01:00
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README.md
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@ -6,20 +6,20 @@ Double Exchange Hamiltonian: Complete Version
1. Dependencies 1. Dependencies
--------------- ---------------
..1. [PETSc](https://www.mcs.anl.gov/petsc/documentation/installation.html) and [SLEPc](http://slepc.upv.es/documentation/current/docs/instal.htm) 1. [PETSc](https://www.mcs.anl.gov/petsc/documentation/installation.html) and [SLEPc](http://slepc.upv.es/documentation/current/docs/instal.htm)
..2. [IRPF90](https://github.com/scemama/irpf90) 2. [IRPF90](https://github.com/scemama/irpf90)
2. Compiling 2. Compiling
------------ ------------
..1. Export environment variables for PETSc and SLEPc 1. Export environment variables for PETSc and SLEPc
```shell ```shell
export PETSC_DIR=${PATH_TO_PETSC_INSTALLATION} export PETSC_DIR=${PATH_TO_PETSC_INSTALLATION}
export SLEPC_DIR=${PATH_TO_SLEPC_INSTALLATION} export SLEPC_DIR=${PATH_TO_SLEPC_INSTALLATION}
``` ```
..2. Make the executable 2. Make the executable
```shell ```shell
make ex1 make ex1
``` ```
@ -27,7 +27,7 @@ make ex1
3. Using DEHam 3. Using DEHam
--------------- ---------------
..1. The DEHam program requires an input file which 1. The DEHam program requires an input file which
has the topology of the Hamiltonian and the various parameters has the topology of the Hamiltonian and the various parameters
as explained below in a sample inputfile: as explained below in a sample inputfile:
@ -45,7 +45,7 @@ make ex1
-1.00,0.0,0.00 # This line gives t -1.00,0.0,0.00 # This line gives t
``` ```
..2. running DEHam 2. running DEHam
```shell ```shell
mpiexec -n [nprocs] ./ex1 inpfile mpiexec -n [nprocs] ./ex1 inpfile
``` ```