| 46 |
|
#define G_TARGETPRESSURE 25 |
| 47 |
|
#define G_TAUTHERMOSTAT 26 |
| 48 |
|
#define G_TAUBAROSTAT 27 |
| 49 |
+ |
#define G_ZCONSTIME 28 |
| 50 |
+ |
#define G_ZCONSMOLINDEX 29 |
| 51 |
|
|
| 52 |
|
|
| 53 |
|
Globals::Globals(){ |
| 88 |
|
addHash( "targetPressure", G_TARGETPRESSURE); |
| 89 |
|
addHash( "tauThermostat", G_TAUTHERMOSTAT); |
| 90 |
|
addHash( "tauBarostat", G_TAUBAROSTAT); |
| 91 |
< |
|
| 91 |
> |
addHash( "zconsTime", G_ZCONSTIME); |
| 92 |
> |
addHash( "zconsMolIndex", G_ZCONSMOLINDEX); |
| 93 |
|
// define some default values |
| 94 |
|
|
| 95 |
|
strcpy( mixingRule,"standard"); //default mixing rules to standard. |
| 123 |
|
have_q_mass = 0; |
| 124 |
|
have_tau_thermostat = 0; |
| 125 |
|
have_tau_barostat = 0; |
| 126 |
+ |
have_zcons_time = 0; |
| 127 |
+ |
have_index_of_all_zcons_mols = 0; |
| 128 |
|
} |
| 129 |
|
|
| 130 |
|
Globals::~Globals(){ |
| 887 |
|
break; |
| 888 |
|
} |
| 889 |
|
break; |
| 890 |
< |
|
| 890 |
> |
|
| 891 |
> |
case G_ZCONSTIME: |
| 892 |
> |
switch( the_type ){ |
| 893 |
> |
|
| 894 |
> |
case STRING: |
| 895 |
> |
the_event->err_msg = |
| 896 |
> |
strdup( "Global error. zcons_time is not a double or int.\n" ); |
| 897 |
> |
return 0; |
| 898 |
> |
break; |
| 899 |
> |
|
| 900 |
> |
case DOUBLE: |
| 901 |
> |
zcons_time = the_event->evt.asmt.rhs.dval; |
| 902 |
> |
return 1; |
| 903 |
> |
break; |
| 904 |
> |
|
| 905 |
> |
case INT: |
| 906 |
> |
zcons_time = (double)the_event->evt.asmt.rhs.ival; |
| 907 |
> |
have_zcons_time = 1; |
| 908 |
> |
return 1; |
| 909 |
> |
break; |
| 910 |
> |
|
| 911 |
> |
default: |
| 912 |
> |
the_event->err_msg = |
| 913 |
> |
strdup( "Global error. zcons_time unrecognized.\n" ); |
| 914 |
> |
return 0; |
| 915 |
> |
break; |
| 916 |
> |
} |
| 917 |
> |
break; |
| 918 |
> |
|
| 919 |
> |
case G_ZCONSMOLINDEX: |
| 920 |
> |
switch( the_type ){ |
| 921 |
> |
|
| 922 |
> |
case STRING: |
| 923 |
> |
the_event->err_msg = |
| 924 |
> |
strdup( "Global error. zconsMolIndex is not a int.\n" ); |
| 925 |
> |
return 0; |
| 926 |
> |
break; |
| 927 |
> |
|
| 928 |
> |
case INT: |
| 929 |
> |
zconsMolIndex.push_back(the_event->evt.asmt.rhs.ival); |
| 930 |
> |
have_index_of_all_zcons_mols = 1; |
| 931 |
> |
return 1; |
| 932 |
> |
break; |
| 933 |
> |
|
| 934 |
> |
default: |
| 935 |
> |
the_event->err_msg = |
| 936 |
> |
strdup( "Global error. zconsMolIndex unrecognized.\n" ); |
| 937 |
> |
return 0; |
| 938 |
> |
break; |
| 939 |
> |
} |
| 940 |
> |
break; |
| 941 |
|
|
| 942 |
|
// add more token cases here. |
| 943 |
|
|
