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Author SHA1 Message Date
6a091424d1 Journal missing in research.bib 2019-08-19 20:15:18 +02:00
9030a2812c Merge branch 'biblio' of github.com:QuantumPackage/qp2 into biblio 2019-08-19 20:14:40 +02:00
57541e2cfd Merge branch 'master' into biblio 2019-08-19 20:12:13 +02:00
fcade8c8f7
Fixed installation issues with OPAM
* Changed native into SSE4.2 in gfortran.cfg

* Fixed rm opam_installer

* Fixing opam installation

* Introduce NO_CACHE in configure for daily test
2019-08-19 20:11:39 +02:00
cd2b606daa
Biblio (#57)
* Update biblio

* Update paper
2019-08-19 18:57:43 +02:00
709ad99b50
Merge branch 'master' into biblio 2019-08-19 18:57:26 +02:00
6619ecb8ac Update paper 2019-08-19 18:42:51 +02:00
b65400c544
Update biblio (#55) 2019-08-19 13:14:01 +02:00
2 changed files with 30 additions and 12 deletions

26
configure vendored
View File

@ -292,6 +292,9 @@ EOF
# Special commands for Travis CI # Special commands for Travis CI
chmod +x "${QP_ROOT}"/external/opam_installer.sh chmod +x "${QP_ROOT}"/external/opam_installer.sh
rm --force ${QP_ROOT}/bin/opam rm --force ${QP_ROOT}/bin/opam
if [[ -n ${NO_CACHE} ]] ; then
rm -rf ${HOME}/.opam
fi
export OPAMROOT=${HOME}/.opam export OPAMROOT=${HOME}/.opam
cat << EOF | bash ${QP_ROOT}/external/opam_installer.sh --no-backup cat << EOF | bash ${QP_ROOT}/external/opam_installer.sh --no-backup
${QP_ROOT}/bin ${QP_ROOT}/bin
@ -301,9 +304,9 @@ ${QP_ROOT}/bin
EOF EOF
rm ${QP_ROOT}/external/opam_installer.sh rm ${QP_ROOT}/external/opam_installer.sh
source ${OPAMROOT}/opam-init/init.sh > /dev/null 2> /dev/null || true # source ${OPAMROOT}/opam-init/init.sh > /dev/null 2> /dev/null || true
#
opam switch create ocaml-base-compiler.4.07.1 # opam switch create ocaml-base-compiler.4.07.1
opam init --verbose --yes --compiler=4.07.1 --disable-sandboxing opam init --verbose --yes --compiler=4.07.1 --disable-sandboxing
eval $(opam env) eval $(opam env)
@ -312,18 +315,19 @@ EOF
else else
# Conventional commands # Conventional commands
execute << EOF execute << EOF
chmod +x "\${QP_ROOT}"/external/opam_installer.sh chmod +x "${QP_ROOT}"/external/opam_installer.sh
"\${QP_ROOT}"/external/opam_installer.sh --no-backup "${QP_ROOT}"/external/opam_installer.sh --no-backup
EOF EOF
execute << EOF execute << EOF
rm --force \${QP_ROOT}/bin/opam rm --force ${QP_ROOT}/bin/opam
export OPAMROOT=\${OPAMROOT:-\${QP_ROOT}/external/opam} export OPAMROOT=${OPAMROOT:-${QP_ROOT}/external/opam}
echo \${QP_ROOT}/bin \ echo ${QP_ROOT}/bin \
| sh \${QP_ROOT}/external/opam_installer.sh | sh ${QP_ROOT}/external/opam_installer.sh
EOF EOF
rm ${QP_ROOT}/external/opam_installer.sh rm ${QP_ROOT}/external/opam_installer.sh
source ${OPAMROOT}/opam-init/init.sh > /dev/null 2> /dev/null || true # source ${OPAMROOT}/opam-init/init.sh > /dev/null 2> /dev/null || true
opam switch create ocaml-base-compiler.4.07.1 || exit 1 # opam switch create ocaml-base-compiler.4.07.1 || exit 1
opam init --verbose --yes --compiler=4.07.1 --disable-sandboxing opam init --verbose --yes --compiler=4.07.1 --disable-sandboxing
eval $(opam env) eval $(opam env)
EOF EOF

View File

@ -1,6 +1,6 @@
%%% ARXIV TO BE UPDATED %%% %%% ARXIV TO BE UPDATED %%%
@article{Giner2019Jul, @article{Giner2019Jul,
author = {Giner, Emmanuel and Scemama, Anthony and Toulouse, Julien and Loos, Pierre-Fran{\ifmmode\mbox{\c{c}}\else\c{c}\fi}ois}, author = {Giner, Emmanuel and Scemama, Anthony and Toulouse, Julien and Loos, Pierre-Fran{\c{c}}ois},
title = {{Chemically Accurate Excitation Energies With Small Basis Sets}}, title = {{Chemically Accurate Excitation Energies With Small Basis Sets}},
journal = {arXiv}, journal = {arXiv},
year = {2019}, year = {2019},
@ -36,6 +36,20 @@
%%%% PUBLISHED PAPERS %%%% PUBLISHED PAPERS
@article{Ferte_2019,
doi = {10.1063/1.5082638},
url = {https://doi.org/10.1063%2F1.5082638},
year = 2019,
month = {feb},
publisher = {{AIP} Publishing},
volume = {150},
number = {8},
pages = {084103},
author = {Anthony Fert{\'{e}} and Emmanuel Giner and Julien Toulouse},
title = {Range-separated multideterminant density-functional theory with a short-range correlation functional of the on-top pair density},
journal = {The Journal of Chemical Physics}
}
@article{Caffarel_2019, @article{Caffarel_2019,
doi = {10.1063/1.5114703}, doi = {10.1063/1.5114703},
url = {https://doi.org/10.1063%2F1.5114703}, url = {https://doi.org/10.1063%2F1.5114703},