1Publications
2============
3
4Peer-reviewed journal articles
5------------------------------
6
72015
8~~~~
9
10+ `Four-Component Relativistic Calculations in Solution with the Polarizable Continuum Model of Solvation: Theory, Implementation, and Application to the Group 16 Dihydrides H2X (X = O, S, Se, Te, Po) <http://pubs.acs.org/doi/abs/10.1021/jp507279y>`_
11+ `Wavelet Formulation of the Polarizable Continuum Model. II. Use of Piecewise Bilinear Boundary Elements <http://pubs.rsc.org/en/content/articlelanding/2015/cp/c5cp03410h>`_
12
132016
14~~~~
15
16+ `A Polarizable Continuum Model for Molecules at Spherical Diffuse Interfaces <http://dx.doi.org/10.1063/1.4943782>`_
17
182017
19~~~~
20
21+ `Four-Component Relativistic Density Functional Theory with the Polarizable Continuum Model: Application to EPR Parameters and Paramagnetic NMR Shifts <http://dx.doi.org/10.1080/00268976.2016.1239846>`_
22+ `Open-ended formulation of self-consistent field response theory with the polarizable continuum model for solvation <https://doi.org/10.1039/C6CP06814F>`_
23+ `Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability <https://pubs.acs.org/doi/abs/10.1021/acs.jctc.7b00174>`_
24+ `Combining frozen-density embedding with the conductor-like screening model using Lagrangian techniques for response properties <http://onlinelibrary.wiley.com/doi/10.1002/jcc.24813/abstract>`_
25
26Theses
27------
28
29+ `The Polarizable Continuum Model Goes Viral! Extensible, Modular and Sustainable Development of Quantum Mechanical Continuum Solvation Models <https://munin.uit.no/handle/10037/10786>`_ Doctoral thesis, Roberto Di Remigio, January 2017.
30
31Presentations
32-------------
33
34+ `A modular implementation of the Polarizable Continuum Model for Solvation <https://www.dropbox.com/s/uzzv8c0wx8eswbc/talk_pisa.pdf?dl=0>`_ Presentation given by Roberto Di Remigio at the workshop in honour of professor Jacopo Tomasi's 80th birthday. Pisa, August 31 - September 1 2014.
35+ `The Polarizable Continuum Model Goes Viral! <http://tinyurl.com/phd-forsvaring>`_ PhD defense, Roberto Di Remigio, January 16 2017.
36+ PCMSolver: a modern, modular approach to include solvation in any quantum chemistry code. Presentation given by Luca Frediani at WATOC 2017. Munich, August 27 - September 1 2017.
37
38Posters
39-------
40
41+ `Plug the solvent in your favorite QM program <https://www.dropbox.com/s/gmj6l54mdj6r9z7/posterICQC.pdf?dl=0>`_ Presented by Luca Frediani at the 14th International Congress of Quantum Chemistry. Boulder, Colorado, June 25-30 2012.
42+ `4-Component Relativistic Calculations in Solution with the Polarizable Continuum Model of Solvation <https://www.dropbox.com/s/edvrimiwh5rlg9y/posterFemEx.pdf?dl=0>`_ Presented by Roberto Di Remigio at the FemEx-Oslo conference. Oslo, June 13-16 2014.
43
44
45