Book chapters
In press
xx.
M. Swart and P.Th. van Duijnen
"Polarizable force fields"
In A course on Biomolecular Simulations, J. Villà Freixa (Ed.), Huygens Editorial, 2015/2016; Ch. 12, in press
2015
9.
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 [abstract]
DOI: 10.1002/9781118898277.ch17

8.
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 [abstract]
DOI: 10.1002/9781118898277.ch2

7.
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 [abstract]
DOI: 10.1002/9781118898277.ch1

6.
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 [abstract]
DOI: 10.1007/978-94-017-9567-8_4
2011
5.
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 [abstract]
DOI: 10.1007/978-94-007-1733-6_4
2010
4.
M. Swart, M. Güell and M. Solà
"Accurate description of spin states and its implications for catalysis"
Book chapter in "Quantum Biochemistry: Electronic structure and biological activity"; Matta, C.F. (Ed.); Wiley, 2010, Vol. 2, Ch. 19, p. 551-583 [abstract]
DOI: 10.1002/9783527629213.ch19

3.
M. Swart, M. Solà and F.M. Bickelhaupt
"Constraining optimized exchange"
Book chapter in "Handbook of Computational Chemistry Research"; C.T. Collett, C.D. Robson (Ed.); Nova Science, 2010, 97-125 [abstract]
DOI: -
2008
2.
P.Th. van Duijnen, M. Swart and L. Jensen
"The Discrete Reaction Field approach for calculating solvent effects"
Book chapter 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 [abstract]
DOI: 10.1007/978-1-4020-8270-2_3
1999
1.
P.Th. van Duijnen, M. Swart and F.C. Grozema
"QM/MM calculation of (hyper-)polarizabilities with the Direct Reaction Field approach"
ACS Symp. Series 1999, 712, 220-232 [abstract]
DOI: 10.1021/bk-1998-0712.ch014