mirror of https://github.com/QMCPACK/qmcpack.git
nexus: added support for skall estimator
git-svn-id: https://subversion.assembla.com/svn/qmcdev/trunk@7247 e5b18d87-469d-4833-9cc0-8cdfa06e9491
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@ -2150,6 +2150,13 @@ class sk(QIxml):
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write_types = obj(hdf5=yesno)
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#end class sk
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class skall(QIxml):
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tag = 'estimator'
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attributes = ['name','type','hdf5','source','target','writeionion']
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identifier = 'name'
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write_types = obj(hdf5=yesno)
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#end class skall
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class gofr(QIxml):
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tag = 'estimator'
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attributes = ['type','name','num_bin','rmax','source']
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@ -2173,6 +2180,7 @@ estimator = QIxmlFactory(
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nofk = nofk,
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mpc = mpc_est,
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sk = sk,
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skall = skall,
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gofr = gofr,
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),
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typekey = 'type',
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@ -2404,7 +2412,7 @@ classes = [ #standard classes
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optimize,cg_optimizer,flex_optimizer,optimize_qmc,wftest,kspace_jastrow,
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header,local,force,forwardwalking,observable,record,rmc,pressure,dmccorrection,
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nofk,mpc_est,distancetable,cpp,element,spline,setparams,
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backflow,transformation,cubicgrid,molecular_orbital_builder,cmc,sk,gofr,
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backflow,transformation,cubicgrid,molecular_orbital_builder,cmc,sk,skall,gofr,
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host,date,user,
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]
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types = dict( #simple types and factories
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