Project ID: plumID:21.015
Source: MetaD/CBM5/post_processing/coordination-groups.dat
Originally used with PLUMED version: 2.5
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr
Click on the labels of the actions for more information on what each action computes
RESTARTActivate restart. More details
The RESTART action with label calculates somethingWHOLEMOLECULESThis action is used to rebuild molecules that can become split by the periodic boundary conditions. More details ENTITY0the atoms that make up a molecule that you wish to align=721-887
C1The COORDINATION action with label C1 calculates the following quantities:| Quantity | Type | Description |
| C1 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=721-722 R_0The r_0 parameter of the switching function=0.3
C1: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=721-722 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C2The COORDINATION action with label C2 calculates the following quantities:| Quantity | Type | Description |
| C2 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=723-724 R_0The r_0 parameter of the switching function=0.3
C2: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=723-724 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C3The COORDINATION action with label C3 calculates the following quantities:| Quantity | Type | Description |
| C3 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=725-726 R_0The r_0 parameter of the switching function=0.3
C3: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=725-726 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C4The COORDINATION action with label C4 calculates the following quantities:| Quantity | Type | Description |
| C4 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=727-728 R_0The r_0 parameter of the switching function=0.3
C4: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=727-728 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C5The COORDINATION action with label C5 calculates the following quantities:| Quantity | Type | Description |
| C5 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=729-729 R_0The r_0 parameter of the switching function=0.3
C5: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=729-729 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C6The COORDINATION action with label C6 calculates the following quantities:| Quantity | Type | Description |
| C6 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=730-731 R_0The r_0 parameter of the switching function=0.3
C6: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=730-731 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C7The COORDINATION action with label C7 calculates the following quantities:| Quantity | Type | Description |
| C7 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=732-733 R_0The r_0 parameter of the switching function=0.3
C7: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=732-733 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C8The COORDINATION action with label C8 calculates the following quantities:| Quantity | Type | Description |
| C8 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=734-735 R_0The r_0 parameter of the switching function=0.3
C8: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=734-735 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C9The COORDINATION action with label C9 calculates the following quantities:| Quantity | Type | Description |
| C9 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=736-737 R_0The r_0 parameter of the switching function=0.3
C9: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=736-737 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C10The COORDINATION action with label C10 calculates the following quantities:| Quantity | Type | Description |
| C10 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=738-743 R_0The r_0 parameter of the switching function=0.3
C10: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=738-743 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C11The COORDINATION action with label C11 calculates the following quantities:| Quantity | Type | Description |
| C11 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=744-745 R_0The r_0 parameter of the switching function=0.3
C11: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=744-745 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C12The COORDINATION action with label C12 calculates the following quantities:| Quantity | Type | Description |
| C12 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=746-746 R_0The r_0 parameter of the switching function=0.3
C12: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=746-746 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C13The COORDINATION action with label C13 calculates the following quantities:| Quantity | Type | Description |
| C13 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=747-748 R_0The r_0 parameter of the switching function=0.3
C13: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=747-748 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C14The COORDINATION action with label C14 calculates the following quantities:| Quantity | Type | Description |
| C14 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=749-750 R_0The r_0 parameter of the switching function=0.3
C14: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=749-750 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C15The COORDINATION action with label C15 calculates the following quantities:| Quantity | Type | Description |
| C15 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=751-752 R_0The r_0 parameter of the switching function=0.3
C15: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=751-752 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C16The COORDINATION action with label C16 calculates the following quantities:| Quantity | Type | Description |
| C16 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=753-757 R_0The r_0 parameter of the switching function=0.3
C16: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=753-757 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C17The COORDINATION action with label C17 calculates the following quantities:| Quantity | Type | Description |
| C17 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=758-759 R_0The r_0 parameter of the switching function=0.3
C17: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=758-759 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C18The COORDINATION action with label C18 calculates the following quantities:| Quantity | Type | Description |
| C18 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=760-761 R_0The r_0 parameter of the switching function=0.3
C18: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=760-761 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C19The COORDINATION action with label C19 calculates the following quantities:| Quantity | Type | Description |
| C19 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=762-763 R_0The r_0 parameter of the switching function=0.3
C19: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=762-763 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C20The COORDINATION action with label C20 calculates the following quantities:| Quantity | Type | Description |
| C20 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=764-765 R_0The r_0 parameter of the switching function=0.3
C20: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=764-765 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C21The COORDINATION action with label C21 calculates the following quantities:| Quantity | Type | Description |
| C21 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=766-767 R_0The r_0 parameter of the switching function=0.3
C21: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=766-767 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C22The COORDINATION action with label C22 calculates the following quantities:| Quantity | Type | Description |
| C22 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=768-769 R_0The r_0 parameter of the switching function=0.3
C22: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=768-769 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C23The COORDINATION action with label C23 calculates the following quantities:| Quantity | Type | Description |
| C23 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=770-772 R_0The r_0 parameter of the switching function=0.3
C23: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=770-772 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C24The COORDINATION action with label C24 calculates the following quantities:| Quantity | Type | Description |
| C24 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=773-776 R_0The r_0 parameter of the switching function=0.3
C24: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=773-776 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C25The COORDINATION action with label C25 calculates the following quantities:| Quantity | Type | Description |
| C25 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=777-778 R_0The r_0 parameter of the switching function=0.3
C25: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=777-778 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C26The COORDINATION action with label C26 calculates the following quantities:| Quantity | Type | Description |
| C26 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=779-780 R_0The r_0 parameter of the switching function=0.3
C26: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=779-780 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C27The COORDINATION action with label C27 calculates the following quantities:| Quantity | Type | Description |
| C27 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=781-783 R_0The r_0 parameter of the switching function=0.3
C27: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=781-783 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C28The COORDINATION action with label C28 calculates the following quantities:| Quantity | Type | Description |
| C28 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=784-786 R_0The r_0 parameter of the switching function=0.3
C28: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=784-786 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C29The COORDINATION action with label C29 calculates the following quantities:| Quantity | Type | Description |
| C29 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=787-791 R_0The r_0 parameter of the switching function=0.3
C29: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=787-791 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C30The COORDINATION action with label C30 calculates the following quantities:| Quantity | Type | Description |
| C30 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=792-793 R_0The r_0 parameter of the switching function=0.3
C30: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=792-793 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C31The COORDINATION action with label C31 calculates the following quantities:| Quantity | Type | Description |
| C31 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=794-794 R_0The r_0 parameter of the switching function=0.3
C31: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=794-794 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C32The COORDINATION action with label C32 calculates the following quantities:| Quantity | Type | Description |
| C32 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=795-796 R_0The r_0 parameter of the switching function=0.3
C32: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=795-796 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C33The COORDINATION action with label C33 calculates the following quantities:| Quantity | Type | Description |
| C33 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=797-801 R_0The r_0 parameter of the switching function=0.3
C33: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=797-801 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C34The COORDINATION action with label C34 calculates the following quantities:| Quantity | Type | Description |
| C34 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=802-807 R_0The r_0 parameter of the switching function=0.3
C34: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=802-807 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C35The COORDINATION action with label C35 calculates the following quantities:| Quantity | Type | Description |
| C35 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=808-809 R_0The r_0 parameter of the switching function=0.3
C35: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=808-809 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C36The COORDINATION action with label C36 calculates the following quantities:| Quantity | Type | Description |
| C36 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=810-811 R_0The r_0 parameter of the switching function=0.3
C36: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=810-811 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C37The COORDINATION action with label C37 calculates the following quantities:| Quantity | Type | Description |
| C37 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=812-813 R_0The r_0 parameter of the switching function=0.3
C37: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=812-813 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C38The COORDINATION action with label C38 calculates the following quantities:| Quantity | Type | Description |
| C38 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=814-815 R_0The r_0 parameter of the switching function=0.3
C38: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=814-815 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C39The COORDINATION action with label C39 calculates the following quantities:| Quantity | Type | Description |
| C39 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=816-817 R_0The r_0 parameter of the switching function=0.3
C39: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=816-817 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C40The COORDINATION action with label C40 calculates the following quantities:| Quantity | Type | Description |
| C40 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=818-819 R_0The r_0 parameter of the switching function=0.3
C40: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=818-819 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C41The COORDINATION action with label C41 calculates the following quantities:| Quantity | Type | Description |
| C41 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=820-821 R_0The r_0 parameter of the switching function=0.3
C41: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=820-821 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C42The COORDINATION action with label C42 calculates the following quantities:| Quantity | Type | Description |
| C42 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=822-823 R_0The r_0 parameter of the switching function=0.3
C42: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=822-823 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C43The COORDINATION action with label C43 calculates the following quantities:| Quantity | Type | Description |
| C43 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=824-825 R_0The r_0 parameter of the switching function=0.3
C43: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=824-825 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C44The COORDINATION action with label C44 calculates the following quantities:| Quantity | Type | Description |
| C44 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=826-827 R_0The r_0 parameter of the switching function=0.3
C44: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=826-827 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C45The COORDINATION action with label C45 calculates the following quantities:| Quantity | Type | Description |
| C45 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=828-828 R_0The r_0 parameter of the switching function=0.3
C45: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=828-828 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C46The COORDINATION action with label C46 calculates the following quantities:| Quantity | Type | Description |
| C46 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=829-830 R_0The r_0 parameter of the switching function=0.3
C46: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=829-830 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C47The COORDINATION action with label C47 calculates the following quantities:| Quantity | Type | Description |
| C47 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=831-835 R_0The r_0 parameter of the switching function=0.3
C47: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=831-835 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C48The COORDINATION action with label C48 calculates the following quantities:| Quantity | Type | Description |
| C48 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=836-836 R_0The r_0 parameter of the switching function=0.3
C48: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=836-836 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C49The COORDINATION action with label C49 calculates the following quantities:| Quantity | Type | Description |
| C49 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=837-838 R_0The r_0 parameter of the switching function=0.3
C49: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=837-838 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C50The COORDINATION action with label C50 calculates the following quantities:| Quantity | Type | Description |
| C50 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=839-844 R_0The r_0 parameter of the switching function=0.3
C50: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=839-844 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C51The COORDINATION action with label C51 calculates the following quantities:| Quantity | Type | Description |
| C51 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=845-846 R_0The r_0 parameter of the switching function=0.3
C51: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=845-846 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C52The COORDINATION action with label C52 calculates the following quantities:| Quantity | Type | Description |
| C52 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=847-848 R_0The r_0 parameter of the switching function=0.3
C52: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=847-848 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C53The COORDINATION action with label C53 calculates the following quantities:| Quantity | Type | Description |
| C53 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=849-850 R_0The r_0 parameter of the switching function=0.3
C53: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=849-850 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C54The COORDINATION action with label C54 calculates the following quantities:| Quantity | Type | Description |
| C54 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=851-851 R_0The r_0 parameter of the switching function=0.3
C54: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=851-851 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C55The COORDINATION action with label C55 calculates the following quantities:| Quantity | Type | Description |
| C55 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=852-853 R_0The r_0 parameter of the switching function=0.3
C55: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=852-853 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C56The COORDINATION action with label C56 calculates the following quantities:| Quantity | Type | Description |
| C56 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=854-855 R_0The r_0 parameter of the switching function=0.3
C56: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=854-855 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C57The COORDINATION action with label C57 calculates the following quantities:| Quantity | Type | Description |
| C57 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=856-857 R_0The r_0 parameter of the switching function=0.3
C57: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=856-857 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C58The COORDINATION action with label C58 calculates the following quantities:| Quantity | Type | Description |
| C58 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=858-859 R_0The r_0 parameter of the switching function=0.3
C58: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=858-859 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C59The COORDINATION action with label C59 calculates the following quantities:| Quantity | Type | Description |
| C59 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=860-861 R_0The r_0 parameter of the switching function=0.3
C59: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=860-861 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C60The COORDINATION action with label C60 calculates the following quantities:| Quantity | Type | Description |
| C60 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=862-862 R_0The r_0 parameter of the switching function=0.3
C60: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=862-862 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C61The COORDINATION action with label C61 calculates the following quantities:| Quantity | Type | Description |
| C61 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=863-863 R_0The r_0 parameter of the switching function=0.3
C61: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=863-863 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C62The COORDINATION action with label C62 calculates the following quantities:| Quantity | Type | Description |
| C62 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=864-867 R_0The r_0 parameter of the switching function=0.3
C62: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=864-867 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C63The COORDINATION action with label C63 calculates the following quantities:| Quantity | Type | Description |
| C63 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=868-871 R_0The r_0 parameter of the switching function=0.3
C63: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=868-871 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C64The COORDINATION action with label C64 calculates the following quantities:| Quantity | Type | Description |
| C64 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=872-875 R_0The r_0 parameter of the switching function=0.3
C64: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=872-875 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C65The COORDINATION action with label C65 calculates the following quantities:| Quantity | Type | Description |
| C65 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=876-879 R_0The r_0 parameter of the switching function=0.3
C65: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=876-879 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C66The COORDINATION action with label C66 calculates the following quantities:| Quantity | Type | Description |
| C66 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=880-883 R_0The r_0 parameter of the switching function=0.3
C66: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=880-883 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
C67The COORDINATION action with label C67 calculates the following quantities:| Quantity | Type | Description |
| C67 | scalar | the value of the coordination |
: COORDINATIONCalculate coordination numbers. This action has hidden defaults. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=884-887 R_0The r_0 parameter of the switching function=0.3
C67: COORDINATIONCalculate coordination numbers. This action uses the defaults shown here. More details GROUPAFirst list of atoms=1-720 GROUPBSecond list of atoms (if empty, N*(N-1)/2 pairs in GROUPA are counted)=884-887 R_0The r_0 parameter of the switching function=0.3 D_0 The d_0 parameter of the switching function=0.0 NN The n parameter of the switching function =6 MM The m parameter of the switching function; 0 implies 2*NN=0
PRINTPrint quantities to a file. More details ARGthe labels of the values that you would like to print to the file=* STRIDE the frequency with which the quantities of interest should be output=1 FILEthe name of the file on which to output these quantities=COORDINATION RESTARTallows per-action setting of restart (YES/NO/AUTO)=NO
