program_restrictions
These are general restrictions to the program.
!-------------------------------------------------------!
$program_restrictions
required !
min_dimension_domain
integer required !
max_dimension_domain
integer required
!
minimum-grid-factor
double
required !
maximum-grid-factor
double
required !
delta-to-treat-grid-factor-as-one double
required !
minimum-grid-width
double
required !
maximum-grid-width
double
required !
maximum-number-of-grid-points
integer required !
lowest-temperature-allowed
double
required !
$end_program_restrictions
required !
!-------------------------------------------------------!
Syntax
min_dimension_domain = 1
don't change, only 1
makes sense
max_dimension_domain
= 3
don't change, only 3
makes sense
minimum-grid-factor = 0.1d0
be careful, geometric series grow up very rapidly
maximum-grid-factor = 10.d0
be careful, geometric series grow up very rapidly
delta-to-treat-grid-factor-as-one = 1.0d-3
to avoid numerical inaccuracies, everything in the interval
1+/- delta is treated as 1
minimum-grid-width = 0.01d0
only a guess, if violated a warning message
is printed to standard output
maximum-grid-width = 200d0
only a guess, if violated a warning message
is printed to standard output
maximum-number-of-grid-points = 400000
only a guess, if exceeded a warning message
is printed to standard output
lowest-temperature-allowed = 1.0d0
in Kelvin
[K]
Question
Can I change the
lattice-temperature to 0
Kelvin in the input file?
Answer
Modify the entry for lowest temperature allowed in database.in:
!----------------------------------------------------------!
$program_restrictions
!
...
!
!lowest-temperature-allowed = 1d0
! [K] (default entry)
lowest-temperature-allowed = 0d0
! [K] <== new
$end_program_restrictions
!
!----------------------------------------------------------!
Enter in your input file:
!----------------------------------------------------------!
$global-parameters
!
!lattice-temperature =
300d0
! [Kelvin]
lattice-temperature =
0d0
! [Kelvin]
$end_global-parameters
!
!----------------------------------------------------------!
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