Action_Thermostats
Add_AtomRandomPerturbation
Add_RotateAroundBondAction
Add_SelectAtomByNameAction
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_StructOpt_integration_tests
AutomationFragmentation_failures
Candidate_v1.6.0
Candidate_v1.6.1
ChangeBugEmailaddress
ChangingTestPorts
ChemicalSpaceEvaluator
Combining_Subpackages
Debian_Package_split
Debian_package_split_molecuildergui_only
Disabling_MemDebug
Docu_Python_wait
EmpiricalPotential_contain_HomologyGraph_documentation
Enable_parallel_make_install
Enhance_userguide
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
FitPartialCharges_GlobalError
Fix_ChronosMutex
Fix_StatusMsg
Fix_StepWorldTime_single_argument
Fix_Verbose_Codepatterns
ForceAnnealing_goodresults
ForceAnnealing_oldresults
ForceAnnealing_tocheck
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
GeometryObjects
Gui_displays_atomic_force_velocity
IndependentFragmentGrids_IntegrationTest
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
JobMarket_unresolvable_hostname_fix
ODR_violation_mpqc_open
PartialCharges_OrthogonalSummation
PythonUI_with_named_parameters
QtGui_reactivate_TimeChanged_changes
Recreated_GuiChecks
RotateToPrincipalAxisSystem_UndoRedo
StoppableMakroAction
Subpackage_levmar
Subpackage_vmg
ThirdParty_MPQC_rebuilt_buildsystem
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
Ubuntu_1604_changes
stable
| Line | |
|---|
| 1 | #include <chemistry/qc/oint3/build.h>
|
|---|
| 2 | int sc::BuildIntV3::i2200eAB(){
|
|---|
| 3 | /* the cost is 21 */
|
|---|
| 4 | double t1;
|
|---|
| 5 | double t2;
|
|---|
| 6 | double t3;
|
|---|
| 7 | double t4;
|
|---|
| 8 | double t5;
|
|---|
| 9 | double t6;
|
|---|
| 10 | double t7;
|
|---|
| 11 | double t8;
|
|---|
| 12 | double t9;
|
|---|
| 13 | t1=int_v_zeta34*int_v_ooze;
|
|---|
| 14 | t2=int_v_oo2zeta12*t1;
|
|---|
| 15 | t1=(-1)*t2;
|
|---|
| 16 | double***restrictxx int_v_list0=int_v_list(0);
|
|---|
| 17 | double**restrictxx int_v_list00=int_v_list0[0];
|
|---|
| 18 | double*restrictxx int_v_list001=int_v_list00[1];
|
|---|
| 19 | t2=int_v_list001[0]*t1;
|
|---|
| 20 | double*restrictxx int_v_list000=int_v_list00[0];
|
|---|
| 21 | t1=int_v_list000[0]*int_v_oo2zeta12;
|
|---|
| 22 | t3=t1+t2;
|
|---|
| 23 | t1=int_v_W0-int_v_p120;
|
|---|
| 24 | double*restrictxx int_v_list002=int_v_list00[2];
|
|---|
| 25 | t2=int_v_list002[0]*t1;
|
|---|
| 26 | t4=t1*t2;
|
|---|
| 27 | t1=t4+t3;
|
|---|
| 28 | double***restrictxx int_v_list2=int_v_list(2);
|
|---|
| 29 | double**restrictxx int_v_list20=int_v_list2[0];
|
|---|
| 30 | double*restrictxx int_v_list200=int_v_list20[0];
|
|---|
| 31 | int_v_list200[5]=t1;
|
|---|
| 32 | t4=int_v_W2-int_v_p122;
|
|---|
| 33 | t5=t4*t2;
|
|---|
| 34 | int_v_list200[4]=t5;
|
|---|
| 35 | t6=int_v_W1-int_v_p121;
|
|---|
| 36 | t7=t2*t6;
|
|---|
| 37 | int_v_list200[3]=t7;
|
|---|
| 38 | t2=int_v_list002[0]*t4;
|
|---|
| 39 | t8=t4*t2;
|
|---|
| 40 | t2=t3+t8;
|
|---|
| 41 | int_v_list200[2]=t2;
|
|---|
| 42 | t8=int_v_list002[0]*t6;
|
|---|
| 43 | t9=t4*t8;
|
|---|
| 44 | int_v_list200[1]=t9;
|
|---|
| 45 | t4=t6*t8;
|
|---|
| 46 | t6=t3+t4;
|
|---|
| 47 | int_v_list200[0]=t6;
|
|---|
| 48 | return 1;}
|
|---|
Note:
See
TracBrowser
for help on using the repository browser.
