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put function is empty. Constructor is enough. 

git-svn-id: https://subversion.assembla.com/svn/qmcdev/trunk@362 e5b18d87-469d-4833-9cc0-8cdfa06e9491
This commit is contained in:
Jeongnim Kim 2005-05-16 02:57:00 +00:00
parent f3563fd417
commit 8ca448da05
1 changed files with 23 additions and 23 deletions
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46
src/QMCWaveFunctions/AtomicOrbitals/HeSTOClementiRottie.cpp
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@ -68,33 +68,33 @@ namespace ohmmsqmc {
bool
HePresetHFBuilder::put(xmlNodePtr cur){
DistanceTableData* d_ei = NULL;
cur = cur->xmlChildrenNode;
while(cur != NULL) {
string cname((const char*)(cur->name));
if(cname == dtable_tag) {
string dtable((const char*)(xmlGetProp(cur,(const xmlChar *)"source")));
dtable.append((const char*)(xmlGetProp(cur,(const xmlChar *)"target")));
d_ei= DistanceTable::getTable(dtable.c_str());
LOGMSG("DistanceTable is selected = " << dtable)
}
cur = cur->next;
}
typedef DiracDeterminant<HePresetHF> Det_t;
HePresetHF* heorb = new HePresetHF;
heorb->setTable(d_ei);
//DistanceTableData* d_ei = NULL;
//cur = cur->xmlChildrenNode;
//while(cur != NULL) {
// string cname((const char*)(cur->name));
// if(cname == dtable_tag) {
// string dtable((const char*)(xmlGetProp(cur,(const xmlChar *)"source")));
// dtable.append((const char*)(xmlGetProp(cur,(const xmlChar *)"target")));
// d_ei= DistanceTable::getTable(dtable.c_str());
// LOGMSG("DistanceTable is selected = " << dtable)
// }
// cur = cur->next;
//}
//typedef DiracDeterminant<HePresetHF> Det_t;
//HePresetHF* heorb = new HePresetHF;
//heorb->setTable(d_ei);
Det_t *DetU = new Det_t(*heorb,0);
DetU->set(0,1);
Det_t* DetD = new Det_t(*heorb,1);
DetD->set(1,1);
//Det_t *DetU = new Det_t(*heorb,0);
//DetU->set(0,1);
//Det_t* DetD = new Det_t(*heorb,1);
//DetD->set(1,1);
SlaterDeterminant<HePresetHF> *asymmpsi=new SlaterDeterminant<HePresetHF>;
//SlaterDeterminant<HePresetHF> *asymmpsi=new SlaterDeterminant<HePresetHF>;
asymmpsi->add(DetU);
asymmpsi->add(DetD);
//asymmpsi->add(DetU);
//asymmpsi->add(DetD);
targetPsi.add(asymmpsi);
//targetPsi.add(asymmpsi);
return true;
}
}