| ADF2017, SCM, Theoretical Chemistry, Vrije Universiteit, Amsterdam, The Netherlands EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ... ADF. Available online: http://www. scm. com (accessed on 20 April 2020), 2014 | 495 | 2014 |
| ADF2017, SCM, theoretical chemistry EJ Baerends, T Ziegler, AJ Atkins, J Autschbach, D Bashford, O Baseggio, ... Vrije Universiteit, 2017 | 398 | 2017 |
| ADF2017 EJ Baerends, T Ziegler, AJ Atkins, J Autschbach, D Bashford, O Baseggio, ... SCM, Theoretical Chemistry, 2017 | 197 | 2017 |
| Theoretical Chemistry EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ... Vrije Universiteit, Amsterdam, The Netherlands https://www. scm. com, 2014 | 102 | 2014 |
| Robust normal modes in vibrational circular dichroism spectra VP Nicu, EJ Baerends Physical Chemistry Chemical Physics 11 (29), 6107-6118, 2009 | 96 | 2009 |
| A vibrational circular dichroism implementation within a Slater-type-orbital based density functional framework and its application to hexa-and hepta-helicenes VP Nicu, J Neugebauer, SK Wolff, EJ Baerends Theoretical Chemistry Accounts 119, 245-263, 2008 | 94 | 2008 |
| Effects of complex formation on vibrational circular dichroism spectra VP Nicu, EJ Baerends The Journal of Physical Chemistry A 112 (30), 6978-6991, 2008 | 92 | 2008 |
| Photonically active bowtie nanoassemblies with chirality continuum P Kumar, T Vo, M Cha, A Visheratina, JY Kim, W Xu, J Schwartz, A Simon, ... Nature 615 (7952), 418-424, 2023 | 84 | 2023 |
| A VCD robust mode analysis of induced chirality: the case of pulegone in chloroform VP Nicu, E Debie, W Herrebout, B Van der Veken, P Bultinck, ... Chirality: The Pharmacological, Biological, and Chemical Consequences of …, 2009 | 79 | 2009 |
| Understanding solvent effects in vibrational circular dichroism spectra:[1, 1′-binaphthalene]-2, 2′-diol in dichloromethane, acetonitrile, and dimethyl sulfoxide solvents VP Nicu, EJ Baerends, PL Polavarapu The Journal of Physical Chemistry A 116 (32), 8366-8373, 2012 | 69 | 2012 |
| Enhancement of IR and VCD intensities due to charge transfer VP Nicu, J Autschbach, EJ Baerends Physical Chemistry Chemical Physics 11 (10), 1526-1538, 2009 | 65 | 2009 |
| Determination of the absolute configurations using exciton chirality method for vibrational circular dichroism: right answers for the wrong reasons? CL Covington, VP Nicu, PL Polavarapu The Journal of Physical Chemistry A 119 (42), 10589-10601, 2015 | 51 | 2015 |
| On the Complementarity of ECD and VCD Techniques VP Nicu, A Mándi, T Kurtán, PL Polavarapu Chirality 26 (9), 525-531, 2014 | 48 | 2014 |
| Taming conformational heterogeneity in and with vibrational circular dichroism spectroscopy MAJ Koenis, Y Xia, SR Domingos, L Visscher, WJ Buma, VP Nicu Chemical science 10 (33), 7680-7689, 2019 | 42 | 2019 |
| ADF2014. SCM. Theoretical Chemistry. Vrije Universiteit. Amsterdam EJ Baerends, T Ziegler, AJ Atkins, J Autschbach, O Baseggio, D Bashford, ... The Netherlands, 2014 | 41 | 2014 |
| Importance of c*–h based modes and large amplitude motion effects in vibrational circular dichroism spectra: the case of the chiral adduct of dimethyl fumarate and anthracene M Passarello, S Abbate, G Longhi, S Lepri, R Ruzziconi, VP Nicu The Journal of Physical Chemistry A 118 (24), 4339-4350, 2014 | 34 | 2014 |
| Signatures of counter-ion association and hydrogen bonding in vibrational circular dichroism spectra VP Nicu, M Heshmat, EJ Baerends Physical Chemistry Chemical Physics 13 (19), 8811-8825, 2011 | 33 | 2011 |
| Amsterdam Density Functional, SCM, Theoretical Chemistry, Vrije Universiteit, Amsterdam, The Netherlands EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ... URL http://www. scm. com. Accessed 3, 17, 2006 | 33 | 2006 |
| Revisiting an old concept: the coupled oscillator model for VCD. Part 1: the generalised coupled oscillator mechanism and its intrinsic connection to the strength of VCD signals VP Nicu Physical Chemistry Chemical Physics 18 (31), 21202-21212, 2016 | 31 | 2016 |
| Amsterdam density functional, SCM, theoretical chemistry EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ... Vrije Universiteit, Amsterdam, The Netherlands, URL http://www. scm. com …, 2013 | 31 | 2013 |
Evert Jan BaerendsProfessor of Theoretical Chemistry, Vrije Universiteit, AmsterdamEmail verificata su vu.nl