Project ID: plumID:21.015
Source: MetaD/CBM73/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=721-882
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)=723-723 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)=723-723 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)=724-725 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)=724-725 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)=726-727 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)=726-727 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)=728-729 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)=728-729 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)=736-740 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)=736-740 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)=741-742 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)=741-742 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)=743-744 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)=743-744 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)=745-745 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)=745-745 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
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)=746-747 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)=746-747 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)=748-749 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)=748-749 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)=750-754 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)=750-754 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)=755-755 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)=755-755 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)=756-757 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)=756-757 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
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)=758-759 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)=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
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)=760-760 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)=760-760 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)=761-762 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)=761-762 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)=763-764 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)=763-764 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)=765-766 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)=765-766 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)=767-768 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)=767-768 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)=769-770 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)=769-770 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)=771-771 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)=771-771 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)=772-773 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)=772-773 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)=774-775 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)=774-775 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)=776-780 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)=776-780 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
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)=781-783 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)=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
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)=784-785 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)=784-785 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)=786-787 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)=786-787 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)=788-789 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)=788-789 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)=790-790 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)=790-790 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)=791-791 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)=791-791 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
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)=792-797 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)=792-797 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)=798-799 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)=798-799 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)=800-801 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)=800-801 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
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)=802-803 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)=802-803 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)=804-804 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)=804-804 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)=805-805 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)=805-805 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)=806-807 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)=806-807 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
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)=808-812 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)=808-812 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)=813-813 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)=813-813 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
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)=814-815 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)=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
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)=816-816 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)=816-816 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)=817-818 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)=817-818 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)=819-819 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)=819-819 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
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)=820-825 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)=820-825 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
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)=826-826 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)=826-826 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)=827-832 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)=827-832 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)=833-833 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)=833-833 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)=834-835 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)=834-835 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
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)=836-836 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)=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
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)=837-842 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)=837-842 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)=843-844 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)=843-844 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
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)=845-846 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)=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
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)=847-848 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)=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
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)=849-851 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)=849-851 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
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)=852-853 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)=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
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)=854-855 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)=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
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)=856-857 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)=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
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)=858-858 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)=858-858 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)=859-862 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)=859-862 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
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)=863-866 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)=863-866 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)=867-870 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)=867-870 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)=871-874 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)=871-874 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)=875-878 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)=875-878 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
C68The COORDINATION action with label C68 calculates the following quantities:| Quantity | Type | Description |
| C68 | 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)=879-882 R_0The r_0 parameter of the switching function=0.3
C68: 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)=879-882 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
