Template:Cite: Difference between revisions

Latest revision as of 16:41, 1 December 2025

This template is similar to how LaTeX manages citations, you have a key and then a text that is included. The template translates this to the mediawiki format. Usage {{cite|key}}.

Mind: Add new citations to the end of this list. Be wary of the whitespace here as it will be introduced to the other document when you include it via the template. A good test is that the preview page should be completely empty and not show any empty lines.

@@ Line 1,400: / Line 1,400: @@
 }}{{
 Reference|key=ryckaertt:jcp:1977|show={{{1}}}|
-bib=J. P. Ryckaert, G. Ciccotti, and H. J. C. Berendsen, J. Comp. Phys. 23, 327 (1977).|
+bib=J. P. Ryckaert, G. Ciccotti, and H. J. C. Berendsen, J. Comp. Phys. '''23''', 327 (1977).|
 link=http://dx.doi.org/10.1016/0021-9991(77)90098-5
 }}{{
 Reference|key=rozzi:prb:2006|show={{{1}}}|
-bib=C. A. Rozzi, D. Varsano, A. Marini, E. K. Gross, A. J. Rubio, Phys. Rev. B 73(20), 20511 (2006).|
+bib=C. A. Rozzi, D. Varsano, A. Marini, E. K. Gross, A. J. Rubio, Phys. Rev. B '''73''', 20511 (2006).|
 link=https://doi.org/10.1103/PhysRevB.73.205119
 }}{{
@@ Line 1,411: / Line 1,411: @@
 link=https://doi.org/10.1103/PhysRevB.96.075448
 }}{{
-Reference|key=vijay:arxiv:2024|show={{{1}}}|
+Reference|key=vijay:prb:2025|show={{{1}}}|
-bib=S. Vijay, M. Schlipf, H. Miranda, F. Karsai, M. Marsman, G. Kresse, arxiv (2024).|
+bib=S. Vijay, M. Schlipf, H. Miranda, F. Karsai, M. Kaltak, M. Marsman, G. Kresse, ''Efficient periodic density functional theory calculations of charged molecules and surfaces using Coulomb kernel truncation'', Phys. Rev. B '''112''', 045409 (2025).|
-link=
+link=https://doi.org/10.1103/cd6s-cdkf
-https://doi.org/10.48550/arXiv.2501.02435
 }}{{
 Reference|key=ihm:jpcss:1979|show={{{1}}}|
-bib=J. Ihm, A. Zunger, M. L. Cohen, Journal of Physics C: Solid State Physics 12(21), 4409 (1979).|
+bib=J. Ihm, A. Zunger, M. L. Cohen, Journal of Physics C: Solid State Physics '''12''', 4409 (1979).|
 link=https://doi.org/10.1088/0022-3719/12/21/009
 }}{{
 Reference|key=ponce:jcp:2015|show={{{1}}}|
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+bib=S. Poncé, Y. Gillet, J. Laflamme Janssen, A. Marini, M. Verstraete, and X. Gonze, ''Temperature dependence of the electronic structure of semiconductors and insulators'', J. Chem. Phys. '''143 (10)''', 102813 (2015).|
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 }}{{
 Reference|key=giustino:rmp:2017|show={{{1}}}|
-bib=F. Giustino, ''Electron-phonon interactions from first principles'', Rev. Mod. Phys. 89, 015003 (2017).|
+bib=F. Giustino, ''Electron-phonon interactions from first principles'', Rev. Mod. Phys. '''89''', 015003 (2017).|
 link=https://doi.org/10.1103/RevModPhys.89.015003
 }}{{
 Reference|key=allen:jpcss:1976|show={{{1}}}|
-bib=P. B. Allen and V. Heine, ''Theory of the temperature dependence of electronic band structures'', J. Phys. C: Solid State Phys. 9 2305 (1976).|
+bib=P. B. Allen and V. Heine, ''Theory of the temperature dependence of electronic band structures'', J. Phys. C: Solid State Phys. '''9''', 2305 (1976).|
 link=https://doi.org/10.1088/0022-3719/9/12/013
 }}{{
 Reference|key=allen:prb:1981|show={{{1}}}|
-bib=P. B. Allen and M. Cardona, ''Theory of the temperature dependence of the direct gap of germanium'', Phys. Rev. B 23, 1495 (1981).|
+bib=P. B. Allen and M. Cardona, ''Theory of the temperature dependence of the direct gap of germanium'', Phys. Rev. B '''23''', 1495 (1981).|
 link=https://doi.org/10.1103/PhysRevB.23.1495
 }}{{
@@ Line 1,497: / Line 1,496: @@
 }}{{
 Reference|key=sharma:jctc:2018|show={{{1}}}|
-bib=Sharma, S., Gross, E. K. U., Sanna, A., and Dewhurst, J. K., ''Source-free exchange-correlation magnetic fields in density functional theory'', J. Chem. Theory Comput., '''14'''(3), 1247-1253 (2018).|
+bib=Sharma, S., Gross, E. K. U., Sanna, A., and Dewhurst, J. K., ''Source-free exchange-correlation magnetic fields in density functional theory'', J. Chem. Theory Comput., '''14''', 1247-1253 (2018).|
 link=https://.doi.org/10.1021/acs.jctc.7b01049
 }}{{
@@ Line 1,837: / Line 1,836: @@
 }}{{
 Reference|key=dunning:1989|show={{{1}}}|
-bib=T. Dunning, ''Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen'', J. Chem. Phys. '''90''' 1007 (1989).|
+bib=T. Dunning, ''Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen'', J. Chem. Phys. '''90''', 1007 (1989).|
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 }}{{
 Reference|key=weigend:ahlrichs:2005|show={{{1}}}|
-bib=F. Weigend, R. Ahlrichs, ''Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy'', Phys. Chem. Chem. Phys. '''7''' 3297 (2005).|
+bib=F. Weigend, R. Ahlrichs, ''Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy'', Phys. Chem. Chem. Phys. '''7''', 3297 (2005).|
 link=https://doi.org/10.1039/B508541A
 }}{{
 Reference|key=jensen:2001|show={{{1}}}|
-bib=F. Jensen, ''Polarization consistent basis sets: Principles'', J. Chem. Phys. '''115''' 9113 (2001).|
+bib=F. Jensen, ''Polarization consistent basis sets: Principles'', J. Chem. Phys. '''115''', 9113 (2001).|
 link=https://doi.org/10.1063/1.1413524
 }}{{
 Reference|key=scuseria:jcp:2008|show={{{1}}}|
-bib=G. Scuseria, T. Henderson, D. Sorensen, ''The ground state correlation energy of the random phase approximation from a ring coupled cluster doubles approach'', J. Chem. Phys. '''129''' 231101 (2008).|
+bib=G. Scuseria, T. Henderson, D. Sorensen, ''The ground state correlation energy of the random phase approximation from a ring coupled cluster doubles approach'', J. Chem. Phys. '''129''', 231101 (2008).|
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 }}{{
 Reference|key=henderson:molphys:2010|show={{{1}}}|
-bib=T. Henderson, G. Scuseria, ''The connection between self-interaction and static correlation: a random phase approximation perspective'', Mol. Phys. '''108''' 2511 (2010).|
+bib=T. Henderson, G. Scuseria, ''The connection between self-interaction and static correlation: a random phase approximation perspective'', Mol. Phys. '''108''', 2511 (2010).|
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 Reference|key=harl:prl:2009|show={{{1}}}|
-bib=J. Harl, G. Kresse, ''Accurate Bulk Properties from Approximate Many-Body Techniques'', Phys. Rev. Lett. '''103''' 056401 (2009).|
+bib=J. Harl, G. Kresse, ''Accurate Bulk Properties from Approximate Many-Body Techniques'', Phys. Rev. Lett. '''103''', 056401 (2009).|
 link=https://doi.org/10.1103/PhysRevLett.103.056401
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 Reference|key=ren:scheffler:2012|show={{{1}}}|
-bib=X. Ren, P. Rinke, C. Joas, M. Scheffler, ''Random-phase approximation and its applications in computational chemistry and materials science'', J. Mater. Sci. '''47''' 7447 (2012).|
+bib=X. Ren, P. Rinke, C. Joas, M. Scheffler, ''Random-phase approximation and its applications in computational chemistry and materials science'', J. Mater. Sci. '''47''', 7447 (2012).|
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 Reference|key=zhang:grueneis:2019|show={{{1}}}|
-bib=I. Zhang, A. Grüneis, ''Coupled Cluster Theory in Materials Science'', Front. Mater. '''6''' 123:1 (2019).|
+bib=I. Zhang, A. Grüneis, ''Coupled Cluster Theory in Materials Science'', Front. Mater. '''6''', 123:1 (2019).|
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 }}{{
 Reference|key=gruber:prx:2018|show={{{1}}}|
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+bib=T. Gruber, K. Liao, T. Tsatsoulis, F. Hummel, A. Grüneis, ''Applying the Coupled-Cluster Ansatz to Solids and Surfaces in the Thermodynamic Limit'', Phys. Rev. X '''8''', 021043 (2018).|
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 Reference|key=shi:jacs:2023|show={{{1}}}|
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+bib=B. Shi, A. Zen, V. Kapil, P. Nagy, A. Grüneis, A. Michaelides, ''Many-Body Methods for Surface Chemistry Come of Age: Achieving Consensus with Experiments'', J. Am. Chem. Soc. '''145''', 25372 (2023).|
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 Reference|key=foulkes:rmp:2001|show={{{1}}}|
-bib=W. Foulkes, L. Mitas, R. Needs, G. Rajagopal, ''Quantum Monte Carlo simulations of solids'', Rev. Mod. Phys. '''77''' 33 (2001).|
+bib=W. Foulkes, L. Mitas, R. Needs, G. Rajagopal, ''Quantum Monte Carlo simulations of solids'', Rev. Mod. Phys. '''77''', 33 (2001).|
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 Reference|key=taheridehkordi:jcp:2023|show={{{1}}}|
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+bib=A. Taheridehkordi, M. Schlipf, Z. Sukurma, M. Humer, A. Grüneis, G. Kresse, ''Phaseless auxiliary field quantum Monte Carlo with projector-augmented wave method for solids'' J. Chem. Phys. '''159''', 044109 (2023).|
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 Reference|key=lischka:cr:2018|show={{{1}}}|
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+bib=H. Lischka, D. Nachtigallová, A. Aquino, P. Szalay, F. Plasser, F. Machado, M. Barbatti, ''Multireference Approaches for Excited States of Molecules'', Chem. Rev. '''118''', 7293 (2018).|
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 Reference|key=festa:jcp:2005|show={{{1}}}|
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+bib=G. Festa, M. Cossi, V. Barone, G. Cantele, D. Ninno, G. Iadonisi, ''A first-principle study of the adsorption of 1-amino-3-cyclopentene on the (100) silicon surface'', J. Chem. Phys. '''122''', 184714 (2005).|
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 Reference|key=tosoni:jcp:2007|show={{{1}}}|
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+bib=S. Tosoni, C. Tuma, J. Sauer, B. Civalleri, P. Ugliengo, ''A comparison between plane wave and Gaussian-type orbital basis sets for hydrogen bonded systems: Formic acid as a test case'', J. Chem. Phys. '''127''', 154102 (2007).|
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+bib=S. Andrews, N. Burton, I. Hillier, J. Holender, M. Gillan, ''Molecular electronic structure calculations employing a plane wave basis: A comparison with Gaussian basis calculations'', Chem. Phys. Lett. '''261''', 521 (1996).|
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+bib=P. Pulay, S. Saebo, M. Malagoli, J. Baker, ''Accuracy and efficiency of atomic basis set methods versus plane wave calculations with ultrasoft pseudopotentials for DNA base molecules'', J. Comput. Chem. '''26''', 599 (2005).|
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+bib=F. Tang, Z. Li, C. Zhang, X. Wu, ''Many-body effects in the X-ray absorption spectra of liquid water'', Proc. Natl. Acad. Sci. USA '''119''',  1 (2022).|
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+bib=G. Gygi, ''All-Electron Plane-Wave Electronic Structure Calculations'', J. Chem. Theory Comput. '''19''', 1300 (2023).|
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@@ Line 1,997: / Line 1,996: @@
 bib=J. Lahnsteiner, M. Rang, M. Bokdam, J. Phys. Chem. C '''128''', 1341 (2024).|
 link=https://doi.org/10.1021/acs.jpcc.3c06590
+}}{{
+Reference|key=souza:prl:02|show={{{1}}}|
+bib=I. Souza, J. Íñiguez, D. Vanderbilt, Phys. Rev. Lett. '''89''', 117602 (2002).|
+link=https://doi.org/10.1103/PhysRevLett.89.117602
+}}{{
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+bib=R. Jinnouchi, F. Karsai, G. Kresse, Chem. Sci. '''16''', 2335 (2025).|
+link=https://doi.org/10.1039/D4SC03378G
+}}{{
+Reference|key=trasatti:1986|show={{{1}}}|
+bib=S. Trasatti, Pure Appl. Chem., '''58''', 955 (1986).|
+link=https://doi.org/10.1351/pac198658070955
 }}