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Merge branch 'master' into daily-test

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Anthony Scemama 2019-08-19 20:17:28 +02:00
commit 532e635a7d
2 changed files with 21 additions and 7 deletions
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13
configure vendored
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@ -315,18 +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

15
docs/source/research.bib
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@ -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 +36,19 @@
%%%% 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},
}
@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},