| Back to the main page of this manual | Input reference of CP2K version 2.3 (Revision 12341) |
| GEO_CHECK | |
| This keyword enables the check that two atoms are never below the minimum value used to construct the splines during the construction of the neighbouring list. Disabling this keyword avoids CP2K to abort in case two atoms are below the minimum value of the radius used to generate the splines. | |
| This optional keyword cannot be repeated and it expects precisely one logical. | |
| The lone keyword behaves as a switch to .TRUE. | |
| Default value: .TRUE. |
| NEIGHBOR_LISTS_FROM_SCRATCH LOGICAL | |
| This keyword enables the building of the neighbouring list from scratch. | |
| This optional keyword cannot be repeated and it expects precisely one logical. | |
| The lone keyword behaves as a switch to .TRUE. | |
| Default value: .FALSE. |
| VERLET_SKIN {REAL} | |
| Defines the Verlet Skin for the generation of the neighbor lists | |
| This optional keyword cannot be repeated and it expects precisely one real. | |
| Default value: 1.00000000E+00 | |
| Default unit: [angstrom] |
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