There are several ways how to call batch_set_state and batch_get_state:
More...
There are several ways how to call batch_set_state and batch_get_state:
- With a 1d array and a single index: batch_get_state(psib, ist, np, psi) In this case, ist is between 1 and nst_linear of the batch (i.e. it is the linear index in the batch) and this call will fetch the first np points of that part of the batch.
- With a 1d array and an index tuple: batch_get_state(psib, (/ist, idim/), np, psi) In this case, ist corresponds to the real state index in the system, i.e., it should be between states_elec_block_min(st, ib) and states_elec_block_max(st, ib) for the batch with index ib. idim gives the spin space index.
- With a 2d array and a single index: batch_get_state(psib, ist, np, psi(:, :)) In this case, ist is between 1 and nst of the batch (i.e. the state index of the batch) and this call will fetch the wavefunctions for all spin indices for that state index. This is more efficient than looping over spin space and getting the wavefunctions for different spin indices individually.
Definition at line 199 of file batch_ops.F90.
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| subroutine | dbatch_set_state1 (this, ist, np, psi) |
| | Write a single state with np points into a batch at position ist. More...
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| subroutine | zbatch_set_state1 (this, ist, np, psi) |
| | Write a single state with np points into a batch at position ist. More...
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| subroutine | dbatch_set_state2 (this, index, np, psi) |
| | Write a single state with np points into a batch at position defined by index. More...
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| subroutine | zbatch_set_state2 (this, index, np, psi) |
| | Write a single state with np points into a batch at position defined by index. More...
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| subroutine | dbatch_set_state3 (this, ii, np, psi) |
| | Write a set of state with np points into a batch. More...
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| subroutine | zbatch_set_state3 (this, ii, np, psi) |
| | Write a set of state with np points into a batch. More...
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◆ dbatch_set_state1()
| subroutine batch_ops_oct_m::batch_set_state::dbatch_set_state1 |
( |
class(batch_t), intent(inout) |
this, |
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integer, intent(in) |
ist, |
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integer, intent(in) |
np, |
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real(real64), dimension(:), intent(in), contiguous |
psi |
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) |
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private |
Write a single state with np points into a batch at position ist.
- Parameters
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| [in,out] | this | batch to write the state to |
| [in] | ist | position where to write |
| [in] | np | number of points |
| [in] | psi | the state to write |
Definition at line 1461 of file batch_ops.F90.
◆ zbatch_set_state1()
| subroutine batch_ops_oct_m::batch_set_state::zbatch_set_state1 |
( |
class(batch_t), intent(inout) |
this, |
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integer, intent(in) |
ist, |
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integer, intent(in) |
np, |
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complex(real64), dimension(:), intent(in), contiguous |
psi |
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) |
| |
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private |
Write a single state with np points into a batch at position ist.
- Parameters
-
| [in,out] | this | batch to write the state to |
| [in] | ist | position where to write |
| [in] | np | number of points |
| [in] | psi | the state to write |
Definition at line 2904 of file batch_ops.F90.
◆ dbatch_set_state2()
| subroutine batch_ops_oct_m::batch_set_state::dbatch_set_state2 |
( |
class(batch_t), intent(inout) |
this, |
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integer, dimension(:), intent(in) |
index, |
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integer, intent(in) |
np, |
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real(real64), dimension(:), intent(in), contiguous |
psi |
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) |
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private |
Write a single state with np points into a batch at position defined by index.
- Parameters
-
| [in,out] | this | batch to write the state into |
| [in] | index | how to access the state. For further information see batch_ops_oct_m::batch_set_state |
| [in] | np | number of points |
| [in] | psi | state to write to the batch |
Definition at line 1570 of file batch_ops.F90.
◆ zbatch_set_state2()
| subroutine batch_ops_oct_m::batch_set_state::zbatch_set_state2 |
( |
class(batch_t), intent(inout) |
this, |
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integer, dimension(:), intent(in) |
index, |
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integer, intent(in) |
np, |
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complex(real64), dimension(:), intent(in), contiguous |
psi |
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) |
| |
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private |
Write a single state with np points into a batch at position defined by index.
- Parameters
-
| [in,out] | this | batch to write the state into |
| [in] | index | how to access the state. For further information see batch_ops_oct_m::batch_set_state |
| [in] | np | number of points |
| [in] | psi | state to write to the batch |
Definition at line 3000 of file batch_ops.F90.
◆ dbatch_set_state3()
| subroutine batch_ops_oct_m::batch_set_state::dbatch_set_state3 |
( |
class(batch_t), intent(inout) |
this, |
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integer, intent(in) |
ii, |
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integer, intent(in) |
np, |
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real(real64), dimension(:, :), intent(in), contiguous |
psi |
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) |
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private |
Write a set of state with np points into a batch.
- Parameters
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| [in,out] | this | batch to write the states into |
| [in] | ii | potision |
| [in] | np | number of points |
| [in] | psi | states to write |
Definition at line 1588 of file batch_ops.F90.
◆ zbatch_set_state3()
| subroutine batch_ops_oct_m::batch_set_state::zbatch_set_state3 |
( |
class(batch_t), intent(inout) |
this, |
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integer, intent(in) |
ii, |
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integer, intent(in) |
np, |
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complex(real64), dimension(:, :), intent(in), contiguous |
psi |
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) |
| |
|
private |
Write a set of state with np points into a batch.
- Parameters
-
| [in,out] | this | batch to write the states into |
| [in] | ii | potision |
| [in] | np | number of points |
| [in] | psi | states to write |
Definition at line 3018 of file batch_ops.F90.
The documentation for this interface was generated from the following file:
1.9.4