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
| Rev | Line | |
|---|
| [0b990d] | 1 | #include <chemistry/qc/oint3/build.h>
|
|---|
| 2 | int sc::BuildIntV3::i2201eAB(){
|
|---|
| 3 | /* the cost is 116 */
|
|---|
| 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 | double t10;
|
|---|
| 14 | double t11;
|
|---|
| 15 | double t12;
|
|---|
| 16 | double t13;
|
|---|
| 17 | double t14;
|
|---|
| 18 | double t15;
|
|---|
| 19 | double t16;
|
|---|
| 20 | double t17;
|
|---|
| 21 | double t18;
|
|---|
| 22 | double t19;
|
|---|
| 23 | double t20;
|
|---|
| 24 | double t21;
|
|---|
| 25 | double t22;
|
|---|
| 26 | double t23;
|
|---|
| 27 | double t24;
|
|---|
| 28 | double t25;
|
|---|
| 29 | double t26;
|
|---|
| 30 | double t27;
|
|---|
| 31 | double t28;
|
|---|
| 32 | double t29;
|
|---|
| 33 | double t30;
|
|---|
| 34 | double t31;
|
|---|
| 35 | t1=int_v_W0-int_v_p120;
|
|---|
| 36 | double***restrictxx int_v_list0=int_v_list(0);
|
|---|
| 37 | double**restrictxx int_v_list00=int_v_list0[0];
|
|---|
| 38 | double*restrictxx int_v_list002=int_v_list00[2];
|
|---|
| 39 | t2=t1*int_v_list002[0];
|
|---|
| 40 | t3=0.5*int_v_ooze;
|
|---|
| 41 | t4=t3*t2;
|
|---|
| 42 | t5=int_v_W0-int_v_p340;
|
|---|
| 43 | t6=t5*int_v_list002[0];
|
|---|
| 44 | t7=int_v_p340-int_v_r30;
|
|---|
| 45 | double*restrictxx int_v_list001=int_v_list00[1];
|
|---|
| 46 | t8=t7*int_v_list001[0];
|
|---|
| 47 | t9=t8+t6;
|
|---|
| 48 | t6=int_v_zeta34*int_v_ooze;
|
|---|
| 49 | t8=int_v_oo2zeta12*t6;
|
|---|
| 50 | t6=(-1)*t8;
|
|---|
| 51 | t8=t6*t9;
|
|---|
| 52 | t9=t8+t4;
|
|---|
| 53 | t10=t5*int_v_list001[0];
|
|---|
| 54 | double*restrictxx int_v_list000=int_v_list00[0];
|
|---|
| 55 | t11=t7*int_v_list000[0];
|
|---|
| 56 | t12=t11+t10;
|
|---|
| 57 | t10=int_v_oo2zeta12*t12;
|
|---|
| 58 | t11=t10+t9;
|
|---|
| 59 | t9=t3*int_v_list002[0];
|
|---|
| 60 | double*restrictxx int_v_list003=int_v_list00[3];
|
|---|
| 61 | t12=t5*int_v_list003[0];
|
|---|
| 62 | t5=t7*int_v_list002[0];
|
|---|
| 63 | t7=t5+t12;
|
|---|
| 64 | t5=t1*t7;
|
|---|
| 65 | t12=t5+t9;
|
|---|
| 66 | t5=t1*t12;
|
|---|
| 67 | t13=t5+t11;
|
|---|
| 68 | double***restrictxx int_v_list2=int_v_list(2);
|
|---|
| 69 | double**restrictxx int_v_list21=int_v_list2[1];
|
|---|
| 70 | double*restrictxx int_v_list210=int_v_list21[0];
|
|---|
| 71 | int_v_list210[17]=t13;
|
|---|
| 72 | t5=int_v_W2-int_v_p342;
|
|---|
| 73 | t11=t5*int_v_list002[0];
|
|---|
| 74 | t14=int_v_p342-int_v_r32;
|
|---|
| 75 | t15=t14*int_v_list001[0];
|
|---|
| 76 | t16=t15+t11;
|
|---|
| 77 | t11=t6*t16;
|
|---|
| 78 | t15=t5*int_v_list001[0];
|
|---|
| 79 | t16=t14*int_v_list000[0];
|
|---|
| 80 | t17=t16+t15;
|
|---|
| 81 | t15=int_v_oo2zeta12*t17;
|
|---|
| 82 | t16=t15+t11;
|
|---|
| 83 | t17=t5*int_v_list003[0];
|
|---|
| 84 | t5=t14*int_v_list002[0];
|
|---|
| 85 | t14=t5+t17;
|
|---|
| 86 | t5=t1*t14;
|
|---|
| 87 | t17=t1*t5;
|
|---|
| 88 | t18=t17+t16;
|
|---|
| 89 | int_v_list210[16]=t18;
|
|---|
| 90 | t17=int_v_W1-int_v_p341;
|
|---|
| 91 | t19=t17*int_v_list002[0];
|
|---|
| 92 | t20=int_v_p341-int_v_r31;
|
|---|
| 93 | t21=t20*int_v_list001[0];
|
|---|
| 94 | t22=t21+t19;
|
|---|
| 95 | t19=t6*t22;
|
|---|
| 96 | t21=t17*int_v_list001[0];
|
|---|
| 97 | t22=t20*int_v_list000[0];
|
|---|
| 98 | t23=t22+t21;
|
|---|
| 99 | t21=int_v_oo2zeta12*t23;
|
|---|
| 100 | t22=t21+t19;
|
|---|
| 101 | t23=t17*int_v_list003[0];
|
|---|
| 102 | t17=t20*int_v_list002[0];
|
|---|
| 103 | t20=t17+t23;
|
|---|
| 104 | t17=t1*t20;
|
|---|
| 105 | t23=t1*t17;
|
|---|
| 106 | t24=t23+t22;
|
|---|
| 107 | int_v_list210[15]=t24;
|
|---|
| 108 | t23=int_v_W2-int_v_p122;
|
|---|
| 109 | t25=t23*t12;
|
|---|
| 110 | int_v_list210[14]=t25;
|
|---|
| 111 | t26=t23*t5;
|
|---|
| 112 | t27=t4+t26;
|
|---|
| 113 | int_v_list210[13]=t27;
|
|---|
| 114 | t26=t23*t17;
|
|---|
| 115 | int_v_list210[12]=t26;
|
|---|
| 116 | t28=int_v_W1-int_v_p121;
|
|---|
| 117 | t29=t12*t28;
|
|---|
| 118 | int_v_list210[11]=t29;
|
|---|
| 119 | t12=t28*t5;
|
|---|
| 120 | int_v_list210[10]=t12;
|
|---|
| 121 | t5=t28*t17;
|
|---|
| 122 | t17=t4+t5;
|
|---|
| 123 | int_v_list210[9]=t17;
|
|---|
| 124 | t4=t10+t8;
|
|---|
| 125 | t5=t23*t7;
|
|---|
| 126 | t8=t23*t5;
|
|---|
| 127 | t5=t8+t4;
|
|---|
| 128 | int_v_list210[8]=t5;
|
|---|
| 129 | t8=t23*int_v_list002[0];
|
|---|
| 130 | t10=t3*t8;
|
|---|
| 131 | t30=t11+t10;
|
|---|
| 132 | t10=t15+t30;
|
|---|
| 133 | t11=t23*t14;
|
|---|
| 134 | t15=t9+t11;
|
|---|
| 135 | t11=t23*t15;
|
|---|
| 136 | t15=t11+t10;
|
|---|
| 137 | int_v_list210[7]=t15;
|
|---|
| 138 | t10=t23*t20;
|
|---|
| 139 | t11=t23*t10;
|
|---|
| 140 | t10=t22+t11;
|
|---|
| 141 | int_v_list210[6]=t10;
|
|---|
| 142 | t11=t28*t7;
|
|---|
| 143 | t7=t23*t11;
|
|---|
| 144 | int_v_list210[5]=t7;
|
|---|
| 145 | t22=t28*t14;
|
|---|
| 146 | t14=t23*t22;
|
|---|
| 147 | t30=t28*int_v_list002[0];
|
|---|
| 148 | t31=t3*t30;
|
|---|
| 149 | t3=t31+t14;
|
|---|
| 150 | int_v_list210[4]=t3;
|
|---|
| 151 | t14=t28*t20;
|
|---|
| 152 | t20=t9+t14;
|
|---|
| 153 | t9=t23*t20;
|
|---|
| 154 | int_v_list210[3]=t9;
|
|---|
| 155 | t14=t28*t11;
|
|---|
| 156 | t11=t4+t14;
|
|---|
| 157 | int_v_list210[2]=t11;
|
|---|
| 158 | t4=t28*t22;
|
|---|
| 159 | t14=t16+t4;
|
|---|
| 160 | int_v_list210[1]=t14;
|
|---|
| 161 | t4=t19+t31;
|
|---|
| 162 | t16=t21+t4;
|
|---|
| 163 | t4=t28*t20;
|
|---|
| 164 | t19=t4+t16;
|
|---|
| 165 | int_v_list210[0]=t19;
|
|---|
| 166 | t4=t6*int_v_list001[0];
|
|---|
| 167 | t6=int_v_oo2zeta12*int_v_list000[0];
|
|---|
| 168 | t16=t6+t4;
|
|---|
| 169 | t4=t1*t2;
|
|---|
| 170 | t1=t4+t16;
|
|---|
| 171 | double**restrictxx int_v_list20=int_v_list2[0];
|
|---|
| 172 | double*restrictxx int_v_list200=int_v_list20[0];
|
|---|
| 173 | int_v_list200[5]=t1;
|
|---|
| 174 | t4=t23*t2;
|
|---|
| 175 | int_v_list200[4]=t4;
|
|---|
| 176 | t6=t28*t2;
|
|---|
| 177 | int_v_list200[3]=t6;
|
|---|
| 178 | t2=t23*t8;
|
|---|
| 179 | t8=t16+t2;
|
|---|
| 180 | int_v_list200[2]=t8;
|
|---|
| 181 | t2=t23*t30;
|
|---|
| 182 | int_v_list200[1]=t2;
|
|---|
| 183 | t20=t28*t30;
|
|---|
| 184 | t21=t16+t20;
|
|---|
| 185 | int_v_list200[0]=t21;
|
|---|
| 186 | return 1;}
|
|---|
Note:
See
TracBrowser
for help on using the repository browser.
