DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science

Andrew M. Teale, Trygve Helgaker, Andreas Savin, Carlo Adamo, Bálint Aradi, Alexei V. Arbuznikov, Paul W. Ayers, Evert Jan Baerends, Vincenzo Barone, Patrizia Calaminici, Eric Cancès, Emily A. Carter, Pratim Kumar Chattaraj, Henry Chermette, Ilaria Ciofini, T. Daniel Crawford, Frank De Proft, John F. Dobson, Claudia Draxl, Thomas Frauenheim, Emmanuel Fromager, Patricio Fuentealba, Laura Gagliardi, Giulia Galli, Jiali Gao, Paul Geerlings, Nikitas Gidopoulos, Peter M. W. Gill, Paola Gori-Giorgi, Andreas Görling, Tim Gould, Stefan Grimme, Oleg Gritsenko, Hans Jørgen Aagaard Jensen, Erin R. Johnson, Robert O. Jones, Martin Kaupp, Andreas M. Köster, Leeor Kronik, Anna I. Krylov, Simen Kvaal, Andre Laestadius, Mel Levy, Mathieu Lewin, Shubin Liu, Pierre-François Loos, Neepa T. Maitra, Frank Neese, John P. Perdew, Katarzyna Pernal, Pascal Pernot, Piotr Piecuch, Elisa Rebolini, Lucia Reining, Pina Romaniello, Adrienn Ruzsinszky, Dennis R. Salahub, Matthias Scheffler, Peter Schwerdtfeger, Viktor N. Staroverov, Jianwei Sun, Erik Tellgren, David J. Tozer, Samuel B. Trickey, Carsten A. Ullrich, Alberto Vela, Giovanni Vignale, Tomasz A. Wesolowski, Xin Xu, Weitao Yang

Open source

DOI
10.1039/d2cp02827a
Published
2022
Container
Physical Chemistry Chemical Physics
Publisher
Royal Society of Chemistry (RSC)
Open access
unknown

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BibTeX

@article{allodium:10.1039/d2cp02827a,
  title = {DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science},
  author = {Andrew M. Teale and Trygve Helgaker and Andreas Savin and Carlo Adamo and Bálint Aradi and Alexei V. Arbuznikov and Paul W. Ayers and Evert Jan Baerends and Vincenzo Barone and Patrizia Calaminici and Eric Cancès and Emily A. Carter and Pratim Kumar Chattaraj and Henry Chermette and Ilaria Ciofini and T. Daniel Crawford and Frank De Proft and John F. Dobson and Claudia Draxl and Thomas Frauenheim and Emmanuel Fromager and Patricio Fuentealba and Laura Gagliardi and Giulia Galli and Jiali Gao and Paul Geerlings and Nikitas Gidopoulos and Peter M. W. Gill and Paola Gori-Giorgi and Andreas Görling and Tim Gould and Stefan Grimme and Oleg Gritsenko and Hans Jørgen Aagaard Jensen and Erin R. Johnson and Robert O. Jones and Martin Kaupp and Andreas M. Köster and Leeor Kronik and Anna I. Krylov and Simen Kvaal and Andre Laestadius and Mel Levy and Mathieu Lewin and Shubin Liu and Pierre-François Loos and Neepa T. Maitra and Frank Neese and John P. Perdew and Katarzyna Pernal and Pascal Pernot and Piotr Piecuch and Elisa Rebolini and Lucia Reining and Pina Romaniello and Adrienn Ruzsinszky and Dennis R. Salahub and Matthias Scheffler and Peter Schwerdtfeger and Viktor N. Staroverov and Jianwei Sun and Erik Tellgren and David J. Tozer and Samuel B. Trickey and Carsten A. Ullrich and Alberto Vela and Giovanni Vignale and Tomasz A. Wesolowski and Xin Xu and Weitao Yang},
  year = {2022},
  journal = {Physical Chemistry Chemical Physics},
  doi = {10.1039/d2cp02827a},
  url = {https://doi.org/10.1039/d2cp02827a}
}

RIS

TY  - JOUR
TI  - DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science
AU  - Andrew M. Teale
AU  - Trygve Helgaker
AU  - Andreas Savin
AU  - Carlo Adamo
AU  - Bálint Aradi
AU  - Alexei V. Arbuznikov
AU  - Paul W. Ayers
AU  - Evert Jan Baerends
AU  - Vincenzo Barone
AU  - Patrizia Calaminici
AU  - Eric Cancès
AU  - Emily A. Carter
AU  - Pratim Kumar Chattaraj
AU  - Henry Chermette
AU  - Ilaria Ciofini
AU  - T. Daniel Crawford
AU  - Frank De Proft
AU  - John F. Dobson
AU  - Claudia Draxl
AU  - Thomas Frauenheim
AU  - Emmanuel Fromager
AU  - Patricio Fuentealba
AU  - Laura Gagliardi
AU  - Giulia Galli
AU  - Jiali Gao
AU  - Paul Geerlings
AU  - Nikitas Gidopoulos
AU  - Peter M. W. Gill
AU  - Paola Gori-Giorgi
AU  - Andreas Görling
AU  - Tim Gould
AU  - Stefan Grimme
AU  - Oleg Gritsenko
AU  - Hans Jørgen Aagaard Jensen
AU  - Erin R. Johnson
AU  - Robert O. Jones
AU  - Martin Kaupp
AU  - Andreas M. Köster
AU  - Leeor Kronik
AU  - Anna I. Krylov
AU  - Simen Kvaal
AU  - Andre Laestadius
AU  - Mel Levy
AU  - Mathieu Lewin
AU  - Shubin Liu
AU  - Pierre-François Loos
AU  - Neepa T. Maitra
AU  - Frank Neese
AU  - John P. Perdew
AU  - Katarzyna Pernal
AU  - Pascal Pernot
AU  - Piotr Piecuch
AU  - Elisa Rebolini
AU  - Lucia Reining
AU  - Pina Romaniello
AU  - Adrienn Ruzsinszky
AU  - Dennis R. Salahub
AU  - Matthias Scheffler
AU  - Peter Schwerdtfeger
AU  - Viktor N. Staroverov
AU  - Jianwei Sun
AU  - Erik Tellgren
AU  - David J. Tozer
AU  - Samuel B. Trickey
AU  - Carsten A. Ullrich
AU  - Alberto Vela
AU  - Giovanni Vignale
AU  - Tomasz A. Wesolowski
AU  - Xin Xu
AU  - Weitao Yang
PY  - 2022
JO  - Physical Chemistry Chemical Physics
DO  - 10.1039/d2cp02827a
UR  - https://doi.org/10.1039/d2cp02827a
ER  -

APA

Teale, A. M., Helgaker, T., Savin, A., Adamo, C., Aradi, B., Arbuznikov, A. V., Ayers, P. W., Baerends, E. J., Barone, V., Calaminici, P., Cancès, E., Carter, E. A., Chattaraj, P. K., Chermette, H., Ciofini, I., Crawford, T. D., Proft, F. D., Dobson, J. F., Draxl, C., Frauenheim, T., Fromager, E., Fuentealba, P., Gagliardi, L., Galli, G., Gao, J., Geerlings, P., Gidopoulos, N., Gill, P. M. W., Gori-Giorgi, P., Görling, A., Gould, T., Grimme, S., Gritsenko, O., Jensen, H. J. A., Johnson, E. R., Jones, R. O., Kaupp, M., Köster, A. M., Kronik, L., Krylov, A. I., Kvaal, S., Laestadius, A., Levy, M., Lewin, M., Liu, S., Loos, P., Maitra, N. T., Neese, F., Perdew, J. P., Pernal, K., Pernot, P., Piecuch, P., Rebolini, E., Reining, L., Romaniello, P., Ruzsinszky, A., Salahub, D. R., Scheffler, M., Schwerdtfeger, P., Staroverov, V. N., Sun, J., Tellgren, E., Tozer, D. J., Trickey, S. B., Ullrich, C. A., Vela, A., Vignale, G., Wesolowski, T. A., Xu, X., & Yang, W. (2022). DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science. Physical Chemistry Chemical Physics. https://doi.org/10.1039/d2cp02827a

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