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COLZERO_THRESHOLD {Real}  
The smallest number that is not zero in the full diagonalization part.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E012 
CSR_SCREENING {Logical}  
Whether distance screening should be applied to improve sparsity of CSR matrices.  
This keyword cannot be repeated and it expects precisely one logical.  
The lone keyword behaves as a switch to .TRUE.  
Default value: .TRUE. 
CUTOUT {Integer} {Integer}  
The number of atoms at the beginning and the end of the structure where the density should not be changed.  
This keyword cannot be repeated and it expects precisely 2 integers.  
Default values: 0 0 
ENERGY_INTERVAL {Real}  
Distance between energy points in eV.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E003 
EPS_DECAY {Real}  
The smallest imaginary part that a decaying eigenvalue may have not to be considered as propagating.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E004 
EPS_EIGVAL_DEGEN {Real}  
Filter for degenerate bands in the injection vector.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E006 
EPS_FERMI {Real}  
Cutoff for the tail of the Fermi function.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 0.00000000E+000 
EPS_LIMIT {Real}  
The smallest eigenvalue that is kept.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E004 
EPS_LIMIT_CC {Real}  
The smallest eigenvalue that is kept on the complex contour.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E006 
EPS_MU {Real}  
Accuracy to which the Fermi level should be determined.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E006 
EPS_SINGULARITY_CURVATURES {Real}  
Filter for degenerate bands in the bandstructure.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E012 
GPUS_PER_POINT {Integer}  
Number of GPUs per energy point for SplitSolve. Needs to be a power of two  
This keyword cannot be repeated and it expects precisely one integer.  
Default value: 2 
INJECTION_METHOD {Keyword}  
Method to solve the eigenvalue problem for the open boundary conditions.  
This keyword cannot be repeated and it expects precisely one keyword.  
Default value: BEYN  
List of valid keywords:

LINEAR_SOLVER {Keyword}  
Preferred solver for solving the linear system of equations.  
This keyword cannot be repeated and it expects precisely one keyword.  
Default value: FULL  
List of valid keywords:

MATRIX_INVERSION_METHOD {Keyword}  
Preferred matrix inversion method.  
This keyword cannot be repeated and it expects precisely one keyword.  
Default value: FULL  
List of valid keywords:

MIN_INTERVAL {Real}  
Smallest enery distance in energy vector.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 1.00000000E004 
NUM_INTERVAL {Integer}  
Max number of energy points per small interval.  
This keyword cannot be repeated and it expects precisely one integer.  
Default value: 10 
NUM_POLE {Integer}  
The number of terms in the PEXSI's pole expansion method.  
This keyword cannot be repeated and it expects precisely one integer.  
Default value: 64 
N_KPOINTS {Integer}  
The number of k points for determination of the singularities.  
This keyword cannot be repeated and it expects precisely one integer.  
Default value: 64 
N_POINTS_INV {Integer}  
Number of integration points for the sigma solver on the complex contour.  
This keyword cannot be repeated and it expects precisely one integer.  
Default value: 64 
OBC_EQUILIBRIUM {Logical}  
Compute the equilibrium density with open boundary conditions.  
This keyword cannot be repeated and it expects precisely one logical.  
The lone keyword behaves as a switch to .TRUE.  
Default value: .FALSE. 
QT_FORMALISM {Keyword}  
Preferred quantum transport formalism to compute the current and density.  
This keyword cannot be repeated and it expects precisely one keyword.  
Default value: QTBM  
List of valid keywords:

REAL_AXIS_INTEGRATION_METHOD {Keyword}  
Integration method for the real axis.  
This keyword cannot be repeated and it expects precisely one keyword.  
Default value: GAUSS_CHEBYSHEV  
List of valid keywords:

TASKS_PER_ENERGY_POINT {Integer}  
Number of tasks per energy point. The value should be a divisor of the total number of MPI ranks.  
This keyword cannot be repeated and it expects precisely one integer.  
Default value: 1 
TASKS_PER_POLE {Integer}  
Number of tasks per pole in the pole expansion method. The value should be a divisor of the total number of MPI ranks.  
This keyword cannot be repeated and it expects precisely one integer.  
Default value: 1 
TEMPERATURE {Real}  
Temperature.  
This keyword cannot be repeated and it expects precisely one real.  
Default value: 3.00000000E+002  
Default unit: [K] 
TRANSPORT_METHOD {Keyword}  
Preferred method for transport calculations.  
This keyword cannot be repeated and it expects precisely one keyword.  
Default value: TRANSPORT  
List of valid keywords:

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