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1999 · 1998 · 1997
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2020 · 2019 · 2018 · 2017 · 2016 · 2015 · 2014 · 2013 · 2012 · 2011 · 2010 · 2009 · 2008 · 2007 · 2006 · 2005 · 2004 · 2003 · 2002 · 2001 · 1999 · 1998 · 1997

In press


20xx.xx
M. Swart and P.Th. van Duijnen
"Polarizable force fields"
In A course on Biomolecular Simulations, J. Villà Freixa (Ed.), Huygens Editorial, Ch. 12, in press
xx-xx

2019


2019.01
M. Gruden, W.R. Browne, M. Swart, C. Duboc
"Computational vs. experimental spectroscopy for transition-metals"
In Transition metals in coordination environments: computational chemistry and catalysis viewpoints, E. Broclawik, T. Borowski, M. Radon (Eds.), Springer, 2019; Ch. 6, 161-183
10.1007/978-3-030-11714-6_6

2015


2015.04
M. Costas and M. Swart
"Summary and Outlook"
In Spin states in biochemistry and inorganic chemistry: Influence on Structure and Reactivity, M. Swart, M. Costas (Eds.), Wiley, 2015; Ch. 17, 435-437
10.1002/9781118898277.ch17

2015.03
C. Daul, M. Zlatar, M. Gruden-Pavlovic and M. Swart
"Application of Density Functional and Density Functional Based Ligand Field Theory to Spin States"
In Spin states in biochemistry and inorganic chemistry: Influence on Structure and Reactivity, M. Swart, M. Costas (Eds.), Wiley, 2015; Ch. 2, 7-34
10.1002/9781118898277.ch2

2015.02
M. Swart and M. Costas
"General Introduction to Spin States"
In Spin states in biochemistry and inorganic chemistry: Influence on Structure and Reactivity, M. Swart, M. Costas (Eds.), Wiley, 2015; Ch. 1, 1-5
10.1002/9781118898277.ch1

2015.01
M. Garcia-Borràs, S. Osuna, J.M. Luis, M. Swart and M. Solà
"Understanding the Exohedral Functionalization of Endohedral Metallofullerenes"
In Exotic Properties of Carbon Nanomatter, M.V. Putz, O. Ori (Eds.), Springer Verlag, Berlin-London-New York, 2015, Ch. 4, p. 67-99
10.1007/978-94-017-9567-8_4

2011


2011.01
S. Osuna, M. Swart and M. Solà
"The Chemical Reactivity of Fullerenes and Endohedral Fullerenes: A Theoretical Perspective"
In Carbon Bonding and Structures: Advances in Physics and Chemistry, M.V. Putz (Ed.), Springer Verlag, Berlin-London-New York, 2011, Ch. 4, p. 57-78
10.1007/978-94-007-1733-6_4

2010


2010.02
M. Swart, M. Güell and M. Solà
"Accurate description of spin states and its implications for catalysis"
In "Quantum Biochemistry: Electronic structure and biological activity"; Matta, C.F. (Ed.); Wiley, 2010, Vol. 2, Ch. 19, p. 551-583
10.1002/9783527629213.ch19

2010.01
M. Swart, M. Solà and F.M. Bickelhaupt
"Constraining optimized exchange"
In "Handbook of Computational Chemistry Research"; C.T. Collett, C.D. Robson (Ed.); Nova Science, 2010, 97-125
-

2008


2008.01
P.Th. van Duijnen, M. Swart and L. Jensen
"The Discrete Reaction Field approach for calculating solvent effects"
In "Solvation Effects on Molecules and Biomolecules: Computational Methods and Applications"; Springer Series "Challenges and Advances in Computational Chemistry and Physics", Vol. 6; S. Canuto (Ed.); Springer, 2008, p. 39-102
10.1007/978-1-4020-8270-2_3

1999


1999.01
P.Th. van Duijnen, M. Swart and F.C. Grozema
"QM/MM calculation of (hyper-)polarizabilities with the Direct Reaction Field approach"
In ACS Symp. Series 1999, 712, 220-232
10.1021/bk-1998-0712.ch014