source: ThirdParty/mpqc_open/src/lib/chemistry/qc/wfn/Makefile@ b7e5b0

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
Last change on this file since b7e5b0 was 860145, checked in by Frederik Heber <heber@…>, 8 years ago

Merge commit '0b990dfaa8c6007a996d030163a25f7f5fc8a7e7' as 'ThirdParty/mpqc_open'

  • Property mode set to 100644
File size: 1.7 KB
Line 
1#
2# Makefile
3#
4# Copyright (C) 1996 Limit Point Systems, Inc.
5#
6# Author: Curtis Janssen <cljanss@ca.sandia.gov>
7# Maintainer: LPS
8#
9# This file is part of the SC Toolkit.
10#
11# The SC Toolkit is free software; you can redistribute it and/or modify
12# it under the terms of the GNU Library General Public License as published by
13# the Free Software Foundation; either version 2, or (at your option)
14# any later version.
15#
16# The SC Toolkit is distributed in the hope that it will be useful,
17# but WITHOUT ANY WARRANTY; without even the implied warranty of
18# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
19# GNU Library General Public License for more details.
20#
21# You should have received a copy of the GNU Library General Public License
22# along with the SC Toolkit; see the file COPYING.LIB. If not, write to
23# the Free Software Foundation, 675 Mass Ave, Cambridge, MA 02139, USA.
24#
25# The U.S. Government is granted a limited license as per AL 91-7.
26#
27
28TOPDIR=../../../../..
29ifndef SRCDIR
30 SRCDIR=$(shell pwd)
31endif
32
33include $(SRCDIR)/$(TOPDIR)/lib/GlobalMakefile
34
35TARGET_TO_MAKE = libSCwfn
36BIN_OR_LIB = LIB
37
38TESTPROGS = wfntest
39
40SRCS = wfn.cc densval.cc natorbval.cc obwfn.cc density.cc hcorewfn.cc \
41 accum.cc nao.cc orbital.cc solvent.cc eht.cc
42
43LIBOBJ= $(SRCS:%.cc=%.$(OBJSUF))
44
45default:: $(DEPENDINCLUDE)
46
47include $(SRCDIR)/$(TOPDIR)/lib/GlobalRules
48
49LIBS = $(shell $(LISTLIBS) $(INCLUDE) $(SRCDIR)/../dft/LIBS.h)
50
51wfntest:: wfntest.$(OBJSUF) $(LIBS)
52 $(LTLINK) $(CXX) $(LDFLAGS) -o wfntest $^ $(SYSLIBS) $(LTLINKBINOPTS)
53
54wfntest.$(OBJSUF): wfntest.cc
55 $(LTCOMP) $(CXX) $(CPPFLAGS) $(CXXFLAGS) -DSRCDIR=\"$(SRCDIR)\" -c $<
56
57$(LIBOBJ:.$(OBJSUF)=.d): $(DEPENDINCLUDE)
58ifneq ($(DODEPEND),no)
59include $(LIBOBJ:.$(OBJSUF)=.d) $(TESTPROGS:%=%.d)
60endif
61
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