atomes 1.2.1
atomes: an atomic scale modeling tool box
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Data Fields
lattice Type Reference

Data Fields

logical glass =.false.
 
logical cubic =.false.
 
double precision volume
 
double precision, dimension(3) modv
 
double precision minv
 
double precision maxv
 
double precision, dimension(3) modr
 
double precision minr
 
double precision maxr
 
double precision, dimension(3, 3) lvect
 
double precision, dimension(3, 3) lrecp
 
double precision, dimension(3, 3) fractocart
 
double precision, dimension(3, 3) carttofrac
 

Detailed Description

Definition at line 654 of file parameters.F90.

Field Documentation

◆ carttofrac

double precision, dimension(3,3) carttofrac

Definition at line 664 of file parameters.F90.

◆ cubic

logical cubic =.false.

Definition at line 656 of file parameters.F90.

◆ fractocart

double precision, dimension(3,3) fractocart

Definition at line 664 of file parameters.F90.

◆ glass

logical glass =.false.

Definition at line 655 of file parameters.F90.

◆ lrecp

double precision, dimension(3,3) lrecp

Definition at line 663 of file parameters.F90.

◆ lvect

double precision, dimension(3,3) lvect

Definition at line 662 of file parameters.F90.

◆ maxr

double precision maxr

Definition at line 661 of file parameters.F90.

◆ maxv

double precision maxv

Definition at line 659 of file parameters.F90.

◆ minr

double precision minr

Definition at line 661 of file parameters.F90.

◆ minv

double precision minv

Definition at line 659 of file parameters.F90.

◆ modr

double precision, dimension(3) modr

Definition at line 660 of file parameters.F90.

◆ modv

double precision, dimension(3) modv

Definition at line 658 of file parameters.F90.

◆ volume

double precision volume

Definition at line 657 of file parameters.F90.

The documentation for this type was generated from the following file: