#define improper_Z_CA_X_Y 180.0 4.60240 2
-;
-; This bit added by DvdS for quartz simulation 2005-05-07
-; These parameters are taken from GROMOS and were also used in
-; Wensink et al. Langmuir 16 (2000) pp. 7392-7400
-;
-[ bondtypes ]
-; i j func b0 kb
- SI OS 1 0.16300 251040. ; From GROMACS
- SI OH 1 0.16300 251040. ;
-
-[ angletypes ]
-; i j k func th0 cth
- SI OS SI 1 155.000 397.480
- OS SI OS 1 109.500 397.480
- OH SI OS 1 109.500 397.480
- SI OH HO 1 109.500 397.480
-
-[ dihedraltypes ]
-; i j k l func coefficients
-; Added DvdS for Quartz simulations
- SI OS 1 0.000 3.766 3
- SI OH 1 0.000 3.766 3
; Added by DvdS for DMSO 17/06/2006
[ bondtypes ]