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Heuvel, Willem Van den
368  Ergebnisse:
Personensuche X
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1

Analytic geometric gradients for the polarizable density em..:

Reinholdt, Peter ; Van den Heuvel, Willem ; Kongsted, Jacob
International Journal of Quantum Chemistry.  123 (2023)  18 - p. , 2023
Link: https://doi.org/10.1002/..
 
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2

Embedding Beyond Electrostatics: The Extended Polarizable D..:

Van den Heuvel, Willem ; Reinholdt, Peter ; Kongsted, Jacob
The Journal of Physical Chemistry B.  127 (2023)  14 - p. 3248-3256 , 2023
Link: https://doi.org/10.1021/..
 
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3

Multiconfigurational SCF and Short-Range DFT Combined with ..:

Van den Heuvel, Willem ; Reinholdt, Peter ; Jensen, Hans Jørgen Aa..
Journal of Chemical Theory and Computation.  18 (2022)  10 - p. 6231-6239 , 2022
Link: https://doi.org/10.1021/..
 
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4

Dipolar Dispersion Forces in Water–Methanol Mixtures: Enhan..:

Besford, Quinn A. ; Van den Heuvel, Willem ; Christofferson, Andrew J.
The Journal of Physical Chemistry B.  126 (2022)  33 - p. 6231-6239 , 2022
Link: https://doi.org/10.1021/..
 
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5

Titanium(III) Member of the Family of Trigonal Building Blo..:

Brown, Andrew ; Saber, Mohamed ; Van den Heuvel, Willem...
Inorganic Chemistry.  56 (2017)  3 - p. 1031-1035 , 2017
Link: https://doi.org/10.1021/..
 
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6

Magnetic Excitations in Polyoxotungstate-Supported Lanthano..:

Vonci, Michele ; Giansiracusa, Marcus J. ; Van den Heuvel, Willem...
Inorganic Chemistry.  56 (2016)  1 - p. 378-394 , 2016
Link: https://doi.org/10.1021/..
 
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7

Ab initio calculations as a quantitative tool in the inelas..:

Vonci, Michele ; Giansiracusa, Marcus J. ; Gable, Robert W....
Chemical Communications.  52 (2016)  10 - p. 2091-2094 , 2016
Link: https://doi.org/10.1039/..
 
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8

Relay-Like Exchange Mechanism through a Spin Radical betwee..:

Marocchi, Simone ; Candini, Andrea ; Klar, David...
ACS Nano.  10 (2016)  10 - p. 9353-9360 , 2016
Link: https://doi.org/10.1021/..
 
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9

Carbonate-Bridged Lanthanoid Triangles: Single-Molecule Mag..:

Giansiracusa, Marcus J. ; Vonci, Michele ; Van den Heuvel, Willem...
Inorganic Chemistry.  55 (2016)  11 - p. 5201-5214 , 2016
Link: https://doi.org/10.1021/..
 
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10

Configuration-averaged 4f orbitals in ab initio calculation..:

Van den Heuvel, Willem ; Calvello, Simone ; Soncini, Alessandro
Physical Chemistry Chemical Physics.  18 (2016)  23 - p. 15807-15814 , 2016
Link: https://doi.org/10.1039/..
 
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11

Dirac cones in the spectrum of bond-decorated graphenes:

Van den Heuvel, Willem ; Soncini, Alessandro
The Journal of Chemical Physics.  140 (2014)  23 - p. , 2014
Link: https://doi.org/10.1063/..
 
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12

Complete spectrum of the infinite-U Hubbard ring using grou..:

Soncini, Alessandro ; Van den Heuvel, Willem
The Journal of Chemical Physics.  140 (2014)  18 - p. , 2014
Link: https://doi.org/10.1063/..
 
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13

NMR chemical shift as analytical derivative of the Helmholt..:

Van den Heuvel, Willem ; Soncini, Alessandro
The Journal of Chemical Physics.  138 (2013)  5 - p. , 2013
Link: https://doi.org/10.1063/..
 
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14

Communication: Paramagnetic NMR chemical shift in a spin st..:

Soncini, Alessandro ; Van den Heuvel, Willem
The Journal of Chemical Physics.  138 (2013)  2 - p. , 2013
Link: https://doi.org/10.1063/..
 
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15

NMR Chemical Shift in an Electronic State with Arbitrary De..:

Van den Heuvel, Willem ; Soncini, Alessandro
Physical Review Letters.  109 (2012)  7 - p. , 2012
Link: https://doi.org/10.1103/..
 
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