bibliography.F File Reference

#include "../base/base_uses.f90"

Go to the source code of this file.

Modules
module	bibliography
	collects all references to literature in CP2K as new algorithms / method are included from literature sources we add a citation, to give credit to the authors (often ourselves, but this need not to be the case), and as a form of documentation.

Functions/Subroutines
subroutine, public	bibliography::add_all_references ()
	adds references that can later be cited / printed using the key

Variables
integer, save, public	bibliography::richters2018
integer, save, public	bibliography::vandevondele2005a
integer, save, public	bibliography::vandevondele2003
integer, save, public	bibliography::laino2005
integer, save, public	bibliography::laino2006
integer, save, public	bibliography::goedecker1996
integer, save, public	bibliography::hartwigsen1998
integer, save, public	bibliography::krack2005
integer, save, public	bibliography::lippert1997
integer, save, public	bibliography::lippert1999
integer, save, public	bibliography::krack2000
integer, save, public	bibliography::krack2002
integer, save, public	bibliography::iannuzzi2005
integer, save, public	bibliography::iannuzzi2006
integer, save, public	bibliography::iannuzzi2007
integer, save, public	bibliography::toukmaji1996
integer, save, public	bibliography::martyna1999
integer, save, public	bibliography::vandevondele2005b
integer, save, public	bibliography::perdew1981
integer, save, public	bibliography::avezac2005
integer, save, public	bibliography::porezag1995
integer, save, public	bibliography::seifert1996
integer, save, public	bibliography::elstner1998
integer, save, public	bibliography::zhechkov2005
integer, save, public	bibliography::henkelman1999
integer, save, public	bibliography::henkelman2014
integer, save, public	bibliography::frigo2005
integer, save, public	bibliography::nose1984a
integer, save, public	bibliography::nose1984b
integer, save, public	bibliography::brelaz1979
integer, save, public	bibliography::bussi2007
integer, save, public	bibliography::genovese2006
integer, save, public	bibliography::genovese2007
integer, save, public	bibliography::evans1983
integer, save, public	bibliography::minary2003
integer, save, public	bibliography::byrd1995
integer, save, public	bibliography::vandevondele2007
integer, save, public	bibliography::ortiz1994
integer, save, public	bibliography::becke1988
integer, save, public	bibliography::perdew1996
integer, save, public	bibliography::zhang1998
integer, save, public	bibliography::perdew2008
integer, save, public	bibliography::lee1988
integer, save, public	bibliography::heyd2006
integer, save, public	bibliography::vydrov2006
integer, save, public	bibliography::heyd2003
integer, save, public	bibliography::heyd2004
integer, save, public	bibliography::vosko1980
integer, save, public	bibliography::aguado2003
integer, save, public	bibliography::essmann1995
integer, save, public	bibliography::ewald1921
integer, save, public	bibliography::darden1993
integer, save, public	bibliography::bazant1996
integer, save, public	bibliography::bazant1997
integer, save, public	bibliography::goedecker2002
integer, save, public	bibliography::lenosky2000
integer, save, public	bibliography::siepmann1995
integer, save, public	bibliography::stillinger1985
integer, save, public	bibliography::tersoff1988
integer, save, public	bibliography::tosi1964a
integer, save, public	bibliography::tosi1964b
integer, save, public	bibliography::yamada2000
integer, save, public	bibliography::dudarev1997
integer, save, public	bibliography::dudarev1998
integer, save, public	bibliography::dewar1977
integer, save, public	bibliography::dewar1985
integer, save, public	bibliography::rocha2006
integer, save, public	bibliography::stewart1989
integer, save, public	bibliography::thiel1992
integer, save, public	bibliography::repasky2002
integer, save, public	bibliography::stewart2007
integer, save, public	bibliography::weber2008
integer, save, public	bibliography::hunt2003
integer, save, public	bibliography::guidon2008
integer, save, public	bibliography::elber1987
integer, save, public	bibliography::jonsson1998
integer, save, public	bibliography::jonsson2000_1
integer, save, public	bibliography::jonsson2000_2
integer, save, public	bibliography::wales2004
integer, save, public	bibliography::stewart1982
integer, save, public	bibliography::e2002
integer, save, public	bibliography::laino2008
integer, save, public	bibliography::blochl1995
integer, save, public	bibliography::tao2003
integer, save, public	bibliography::vandevondele2006
integer, save, public	bibliography::vanvoorhis2015
integer, save, public	bibliography::hu2007
integer, save, public	bibliography::hu2010
integer, save, public	bibliography::grimme2006
integer, save, public	bibliography::branduardi2007
integer, save, public	bibliography::schenter2008
integer, save, public	bibliography::beckeroussel1989
integer, save, public	bibliography::proynov2007
integer, save, public	bibliography::vandencic2006
integer, save, public	bibliography::becke1997
integer, save, public	bibliography::foiles1986
integer, save, public	bibliography::ricci2003
integer, save, public	bibliography::kolafa2004
integer, save, public	bibliography::kuhne2007
integer, save, public	bibliography::kunert2003
integer, save, public	bibliography::ceriotti2009
integer, save, public	bibliography::ceriotti2009b
integer, save, public	bibliography::guidon2009
integer, save, public	bibliography::barducbus2008
integer, save, public	bibliography::grimme2010
integer, save, public	bibliography::guidon2010
integer, save, public	bibliography::marques2012
integer, save, public	bibliography::jones2011
integer, save, public	bibliography::bernstein2009
integer, save, public	bibliography::bernstein2012
integer, save, public	bibliography::dick1958
integer, save, public	bibliography::mitchell1993
integer, save, public	bibliography::devynck2012
integer, save, public	bibliography::vandevondele2012
integer, save, public	bibliography::niklasson2003
integer, save, public	bibliography::shao2003
integer, save, public	bibliography::vandevondele2002
integer, save, public	bibliography::dion2004
integer, save, public	bibliography::romanperez2009
integer, save, public	bibliography::delben2012
integer, save, public	bibliography::sabatini2013
integer, save, public	bibliography::delben2013
integer, save, public	bibliography::kikuchi2009
integer, save, public	bibliography::putrino2000
integer, save, public	bibliography::putrino2002
integer, save, public	bibliography::sebastiani2001
integer, save, public	bibliography::weber2009
integer, save, public	bibliography::tran2013
integer, save, public	bibliography::golze2013
integer, save, public	bibliography::golze2015
integer, save, public	bibliography::golze2017a
integer, save, public	bibliography::golze2017b
integer, save, public	bibliography::tuckerman1992
integer, save, public	bibliography::zhao1994
integer, save, public	bibliography::tozer1996
integer, save, public	bibliography::goedecker2004
integer, save, public	bibliography::rengaraj2020
integer, save, public	bibliography::khaliullin2013
integer, save, public	bibliography::kruse2012
integer, save, public	bibliography::hutter2014
integer, save, public	bibliography::bengtsson1999
integer, save, public	bibliography::kantorovich2008
integer, save, public	bibliography::kantorovich2008a
integer, save, public	bibliography::wellendorff2012
integer, save, public	bibliography::niklasson2014
integer, save, public	bibliography::borstnik2014
integer, save, public	bibliography::rayson2009
integer, save, public	bibliography::grimme2011
integer, save, public	bibliography::grimme2015fod
integer, save, public	bibliography::fattebert2002
integer, save, public	bibliography::andreussi2012
integer, save, public	bibliography::khaliullin2007
integer, save, public	bibliography::khaliullin2008
integer, save, public	bibliography::merlot2014
integer, save, public	bibliography::lin2009
integer, save, public	bibliography::lin2013
integer, save, public	bibliography::lin2016ace
integer, save, public	bibliography::batzner2022
integer, save, public	bibliography::batatia2022
integer, save, public	bibliography::delben2015
integer, save, public	bibliography::souza2002
integer, save, public	bibliography::umari2002
integer, save, public	bibliography::stengel2009
integer, save, public	bibliography::luber2014
integer, save, public	bibliography::berghold2011
integer, save, public	bibliography::delben2015b
integer, save, public	bibliography::campana2009
integer, save, public	bibliography::schiffmann2015
integer, save, public	bibliography::bruck2014
integer, save, public	bibliography::rappe1992
integer, save, public	bibliography::ceriotti2012
integer, save, public	bibliography::ceriotti2010
integer, save, public	bibliography::walewski2014
integer, save, public	bibliography::monkhorst1976
integer, save, public	bibliography::macdonald1978
integer, save, public	bibliography::worlton1972
integer, save, public	bibliography::gilbert2008
integer, save, public	bibliography::schonherr2014
integer, save, public	bibliography::ceriotti2014
integer, save, public	bibliography::banihashemian2016
integer, save, public	bibliography::kapil2016
integer, save, public	bibliography::heinzmann1976
integer, save, public	bibliography::ehrhardt1985
integer, save, public	bibliography::rybkin2016
integer, save, public	bibliography::west2006
integer, save, public	bibliography::bates2013
integer, save, public	bibliography::andermatt2016
integer, save, public	bibliography::zhu2016
integer, save, public	bibliography::schuett2016
integer, save, public	bibliography::lu2004
integer, save, public	bibliography::becke1988b
integer, save, public	bibliography::migliore2009
integer, save, public	bibliography::mavros2015
integer, save, public	bibliography::holmberg2017
integer, save, public	bibliography::marek2014
integer, save, public	bibliography::stoychev2016
integer, save, public	bibliography::futera2017
integer, save, public	bibliography::bailey2006
integer, save, public	bibliography::papior2017
integer, save, public	bibliography::lehtola2018
integer, save, public	bibliography::brieuc2016
integer, save, public	bibliography::barca2018
integer, save, public	bibliography::scheiber2018
integer, save, public	bibliography::huang2011
integer, save, public	bibliography::heaton_burgess2007
integer, save, public	bibliography::schuett2018
integer, save, public	bibliography::holmberg2018
integer, save, public	bibliography::togo2018
integer, save, public	bibliography::staub2019
integer, save, public	bibliography::grimme2013
integer, save, public	bibliography::grimme2016
integer, save, public	bibliography::grimme2017
integer, save, public	bibliography::asgeirsson2017
integer, save, public	bibliography::bannwarth2019
integer, save, public	bibliography::katbashev2025
integer, save, public	bibliography::kondov2007
integer, save, public	bibliography::clabaut2020
integer, save, public	bibliography::clabaut2021
integer, save, public	bibliography::ren2011
integer, save, public	bibliography::ren2013
integer, save, public	bibliography::cohen2000
integer, save, public	bibliography::rogers2002
integer, save, public	bibliography::filippetti2000
integer, save, public	bibliography::limpanuparb2011
integer, save, public	bibliography::martin2003
integer, save, public	bibliography::yin2017
integer, save, public	bibliography::goerigk2017
integer, save, public	bibliography::wilhelm2016a
integer, save, public	bibliography::wilhelm2016b
integer, save, public	bibliography::wilhelm2017
integer, save, public	bibliography::wilhelm2018
integer, save, public	bibliography::wilhelm2021
integer, save, public	bibliography::lass2018
integer, save, public	bibliography::cp2kqs2020
integer, save, public	bibliography::iannuzzi2026
integer, save, public	bibliography::behler2007
integer, save, public	bibliography::behler2011
integer, save, public	bibliography::schran2020a
integer, save, public	bibliography::schran2020b
integer, save, public	bibliography::rycroft2009
integer, save, public	bibliography::thomas2015
integer, save, public	bibliography::brehm2018
integer, save, public	bibliography::brehm2020
integer, save, public	bibliography::shigeta2001
integer, save, public	bibliography::heinecke2016
integer, save, public	bibliography::brehm2021
integer, save, public	bibliography::bussy2021a
integer, save, public	bibliography::bussy2021b
integer, save, public	bibliography::ditler2021
integer, save, public	bibliography::ditler2022
integer, save, public	bibliography::mattiat2019
integer, save, public	bibliography::mattiat2022
integer, save, public	bibliography::belleflamme2023
integer, save, public	bibliography::knizia2013
integer, save, public	bibliography::musaelian2023
integer, save, public	bibliography::eriksen2020
integer, save, public	bibliography::bussy2023
integer, save, public	bibliography::bussy2024
integer, save, public	bibliography::wang2018
integer, save, public	bibliography::zeng2023
integer, save, public	bibliography::graml2024
integer, save, public	bibliography::solca2024
integer, save, public	bibliography::caldeweyher2017
integer, save, public	bibliography::caldeweyher2019
integer, save, public	bibliography::caldeweyher2020
integer, save, public	bibliography::wittmann2024
integer, save, public	bibliography::freeman1977
integer, save, public	bibliography::gruneis2009
integer, save, public	bibliography::blaha2010
integer, save, public	bibliography::kressefurthmueller1996
integer, save, public	bibliography::stein2022
integer, save, public	bibliography::stein2024
integer, save, public	bibliography::pracht2019
integer, save, public	bibliography::blase2018
integer, save, public	bibliography::blase2020
integer, save, public	bibliography::bruneval2015
integer, save, public	bibliography::golze2019
integer, save, public	bibliography::gui2018
integer, save, public	bibliography::jacquemin2017
integer, save, public	bibliography::liu2020
integer, save, public	bibliography::sander2015
integer, save, public	bibliography::schreiber2008
integer, save, public	bibliography::vansetten2015
integer, save, public	bibliography::setyawan2010
integer, save, public	bibliography::ahart2024
integer, save, public	bibliography::knysh2024
integer, save, public	bibliography::schambeck2024
integer, save, public	bibliography::mewes2018
integer, save, public	bibliography::sertcan2024
integer, save, public	bibliography::drautz2019
integer, save, public	bibliography::lysogorskiy2021
integer, save, public	bibliography::bochkarev2024
integer, save, public	bibliography::vazdacruz2021
integer, save, public	bibliography::chen2025
integer, save, public	bibliography::hernandez2025
integer, save, public	bibliography::marek2025
integer, save, public	bibliography::hehn2022
integer, save, public	bibliography::hehn2024
integer, save, public	bibliography::pasquier2025
integer, save, public	bibliography::hanasaki2025
integer, save, public	bibliography::graml2026
integer, save, public	bibliography::tan2025
integer, save, public	bibliography::broyden1965
integer, save, public	bibliography::johnson1988
integer, save, public	bibliography::kerker1981
integer, save, public	bibliography::fuho1983
integer, save, public	bibliography::methfesselpaxton1989
integer, save, public	bibliography::marzari1999
integer, save, public	bibliography::dossantos2023
integer, save, public	bibliography::mermin1965
integer, save, public	bibliography::kuhneheskeprodan2020
integer, save, public	bibliography::schreder2021
integer, save, public	bibliography::schreder2024_1
integer, save, public	bibliography::schreder2024_2
integer, save, public	bibliography::shiga2022
integer, save, public	bibliography::lindh1995
integer, save, public	bibliography::chai2024a
integer, save, public	bibliography::rullan2026
integer, save, public	bibliography::sundararaman2017
integer, save, public	bibliography::andreussi2019
integer, save, public	bibliography::chai2025a
integer, save, public	bibliography::neugebauer2023
integer, save, public	bibliography::chai2024b
integer, save, public	bibliography::moynihan2017
integer, save, public	bibliography::cococcioni2005
integer, save, public	bibliography::cances2000
integer, save, public	bibliography::herbst2022
integer, save, public	bibliography::zhang2025
integer, save, public	bibliography::gresch2017
integer, save, public	bibliography::soluyanov2011
integer, save, public	bibliography::davidson1975
integer, save, public	bibliography::olsen1988
integer, save, public	bibliography::stratmann1998
integer, save, public	bibliography::vecharynski2017
integer, save, public	bibliography::stathopoulos1998
integer, save, public	bibliography::bai2012
integer, save, public	bibliography::fukaya2014
integer, save, public	bibliography::schreder2024_3