Difference between revisions of "Eph md prev time"
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(Created page with "<code>eph_md_prev_time</code> sets the value of time evolved till the last MD step of a previous run. It is used only in case of restarting a simulation. This value is used wh...") |
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| Float | | Float | ||
| Floating point values | | Floating point values | ||
| − | | 0.0 | + | | 0.0 fs |
| <code>[[nonadiabatic_processes]]</code>, <code>[[eph_freq_mesh_Tout]]</code>, <code>[[eph_md_last_step]]</code>, <code>[[eph_E_prev_time]]</code> | | <code>[[nonadiabatic_processes]]</code>, <code>[[eph_freq_mesh_Tout]]</code>, <code>[[eph_md_last_step]]</code>, <code>[[eph_E_prev_time]]</code> | ||
| Use the last MD time value in fs units from file <code>eph-EnergySharingData.txt</code> | | Use the last MD time value in fs units from file <code>eph-EnergySharingData.txt</code> | ||
|} | |} | ||
Latest revision as of 11:34, 28 September 2023
eph_md_prev_time sets the value of time evolved till the last MD step of a previous run. It is used only in case of restarting a simulation. This value is used while writing data to the eph-EnergySharingData.txt output file. In this file only MD times are written by adding with the given value in femtoseconds units.
Summary
| Required/optional | Type | Accepted values | Default | See also | Remarks |
|---|---|---|---|---|---|
| Optional | Float | Floating point values | 0.0 fs | nonadiabatic_processes, eph_freq_mesh_Tout, eph_md_last_step, eph_E_prev_time
|
Use the last MD time value in fs units from file eph-EnergySharingData.txt
|
