Ad van der Avoird
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Dutch theoretical chemist
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Chemistry
Ad van der Avoird's Degrees
- PhD Theoretical Chemistry University of Amsterdam
Why Is Ad van der Avoird Influential?
(Suggest an Edit or Addition)According to Wikipedia, Ad van der Avoird is a Dutch theoretical chemist. He is an emeritus professor of theoretical chemistry at the Radboud University Nijmegen. Education and career Van der Avoird was born on 19 April 1943 in Eindhoven. He studied at Eindhoven University of Technology, obtaining his PhD under George Schuit in 1968. In 1971, he joined the faculty of Radboud University Nijmegen and later became professor of theoretical chemistry. He took up emeritus status in 2008 although he kept working. In 2013 Van der Avoird provided a theory on the relation between two benzene rings and their possible motion, the discovery was published with Gerard Meijer and a German research team in a paper in Angewandte Chemie. The model solved a decade old scientific issue.
Ad van der Avoird's Published Works
Number of citations in a given year to any of this author's works
Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author
Published Works
- Predictions of the Properties of Water from First Principles (2007) (335)
- Intermolecular potentials, internal motions, and spectra of van der waals and hydrogen-bonded complexes. (2000) (130)
- Quantum-State Resolved Bimolecular Collisions of Velocity-Controlled OH with NO Radicals (2012) (109)
- Imaging resonances in low-energy NO-He inelastic collisions (2015) (102)
- Polarizable interaction potential for water from coupled cluster calculations. I. Analysis of dimer potential energy surface. (2008) (99)
- New ab initio potential energy surface and the vibration-rotation-tunneling levels of (H2O)2 and (D2O)2. (2008) (97)
- Directly probing anisotropy in atom–molecule collisions through quantum scattering resonances (2016) (96)
- Spectra of water dimer from a new ab initio potential with flexible monomers. (2012) (90)
- State-resolved diffraction oscillations imaged for inelastic collisions of NO radicals with He, Ne and Ar. (2014) (88)
- Polarizable interaction potential for water from coupled cluster calculations. II. Applications to dimer spectra, virial coefficients, and simulations of liquid water. (2008) (85)
- An accurate analytic representation of the water pair potential. (2008) (81)
- Update of the HITRAN collision-induced absorption section (2019) (71)
- Vibration-rotation-tunneling states of the benzene dimer: an ab initio study. (2010) (68)
- Quantum dynamical resonances in low-energy CO(j = 0) + He inelastic collisions. (2015) (65)
- Interaction of NH(X 3Sigma-) with He: potential energy surface, bound states, and collisional Zeeman relaxation. (2005) (63)
- Rovibrational states of the H2O-H2 complex: an ab initio calculation. (2011) (61)
- Interaction potential for water dimer from symmetry-adapted perturbation theory based on density functional description of monomers. (2006) (58)
- Structure of the benzene dimer--governed by dynamics. (2013) (56)
- Predictions for water clusters from a first-principles two- and three-body force field. (2014) (55)
- Imaging the onset of the resonance regime in low-energy NO-He collisions (2020) (51)
- Scattering resonances in slow NH3-He collisions. (2011) (50)
- Scattering resonances in bimolecular collisions between NO radicals and H2 challenge the theoretical gold standard (2018) (50)
- DYNAMICS OF CO IN AMORPHOUS WATER-ICE ENVIRONMENTS (2013) (47)
- Imaging quantum stereodynamics through Fraunhofer scattering of NO radicals with rare-gas atoms. (2017) (46)
- New CO-CO interaction potential tested by rovibrational calculations. (2005) (45)
- Quantum reactive scattering of ultracold NH(X (3)Σ(-)) radicals in a magnetic trap. (2013) (43)
- Ab initio computed diabatic potential energy surfaces of OH-HCl. (2005) (39)
- High-resolution imaging of velocity-controlled molecular collisions using counterpropagating beams. (2014) (33)
- Vibration-rotation-tunneling levels of the water dimer from an ab initio potential surface with flexible monomers. (2009) (32)
- Higher energy states in the CO dimer: millimeter-wave spectra and rovibrational calculations. (2007) (30)
- Ab initio calculation of the NH(3sigma-)-NH(3sigma-) interaction potentials in the quintet, triplet, and singlet states. (2005) (30)
- Quantum mechanical calculation of the collision-induced absorption spectra of N2-N2 with anisotropic interactions. (2015) (30)
- Resonances in rotationally inelastic scattering of NH3 and ND3 with H2. (2015) (30)
- Steric asymmetry and lambda-doublet propensities in state-to-state rotationally inelastic scattering of NO(2Pi(1/2)) with He. (2004) (30)
- Observation of correlated excitations in bimolecular collisions (2018) (27)
- Rotationally inelastic scattering of OH by molecular hydrogen: Theory and experiment. (2015) (27)
- Unraveling the internal dynamics of the benzene dimer: a combined theoretical and microwave spectroscopy study. (2013) (24)
- Water trimer torsional spectrum from accurate ab initio and semiempirical potentials. (2008) (24)
- Collision-induced absorption with exchange effects and anisotropic interactions: theory and application to H2 - H2. (2015) (23)
- Resonances in rotationally inelastic scattering of OH(X2Π) with helium and neon. (2012) (23)
- Three-dimensional ab initio potential energy surface for H-CO(X̃(2)A'). (2013) (23)
- Bound states of the OH(2Pi)-HCl complex on ab initio diabatic potentials. (2009) (23)
- Overtone vibrational spectroscopy in H2-H2O complexes: a combined high level theoretical ab initio, dynamical and experimental study. (2012) (22)
- Scattering of NH3 and ND3 with rare gas atoms at low collision energy. (2015) (22)
- State-to-state resolved differential cross sections for rotationally inelastic scattering of ND3 with He. (2014) (22)
- Potential energy surface and bound states of the NH3-Ar and ND3-Ar complexes. (2014) (22)
- The interaction of OH(X²Π) with H₂: ab initio potential energy surfaces and bound states. (2014) (20)
- Vibrational predissociation in the HCl dimer. (2004) (19)
- O2−O2 and O2−N2 collision-induced absorption mechanisms unravelled (2018) (18)
- Ab initio potential-energy surface for the reaction Ca+HCl-->CaCl+H. (2005) (18)
- Cold Collisions in a Molecular Synchrotron. (2017) (18)
- Ab initio potential energy surfaces for NH((3)sigma(-))-NH((3)sigma(-)) with analytical long range. (2009) (18)
- Cold and ultracold NH-NH collisions: the field-free case. (2010) (18)
- Ab initio treatment of the chemical reaction precursor complex Cl(2P)-HF. 1. Three-dimensional diabatic potential energy surfaces. (2006) (17)
- Interaction of H2O with CO: potential energy surface, bound states and scattering calculations. (2018) (16)
- Near dissociation states for H2+-He on MRCI and FCI potential energy surfaces. (2019) (16)
- Quantifying the interplay between fine structure and geometry of an individual molecule on a surface (2020) (16)
- State-to-state scattering of highly vibrationally excited NO at broadly tunable energies (2020) (15)
- Imaging diffraction oscillations for inelastic collisions of NO radicals with He and D2. (2017) (15)
- Characterization of methanol as a magnetic field tracer in star-forming regions (2018) (15)
- Inelastic Scattering of CO with He: Polarization Dependent Differential State-to-State Cross Sections. (2015) (14)
- Hyperfine interactions and internal rotation in methanol. (2016) (14)
- Ab initio potential-energy surface and rovibrational states of the HCN-HCl complex. (2006) (14)
- Communication: Magnetic dipole transitions in the OH A 2Σ+ ← X 2Π system. (2012) (13)
- Rotationally inelastic scattering of ND3 with H2 as a probe of the intermolecular potential energy surface (2015) (13)
- Differential Cross Sections for State-to-State Collisions of NO( v = 10) in Near-Copropagating Beams. (2019) (12)
- Rotational study of the CH4-CO complex: Millimeter-wave measurements and ab initio calculations. (2015) (11)
- Collisional and photoinitiated reaction dynamics in the ground electronic state of Ca-HCl. (2005) (11)
- Ab initio potential and rotational spectra of the CO-N2 complex. (2018) (11)
- Collision dynamics of symmetric top molecules: a comparison of the rotationally inelastic scattering of CD3 and ND3 with He. (2014) (11)
- Direct Extraction of Alignment Moments from Inelastic Scattering Images. (2015) (10)
- Communication: Multiple-property-based diabatization for open-shell van der Waals molecules. (2016) (10)
- Potential energy and dipole moment surfaces of the triplet states of the O2(X3Σg-) - O2(X3Σg-,a1Δg,b1Σg+) complex. (2017) (10)
- The elusive S2 state, the S1/S2 splitting, and the excimer states of the benzene dimer. (2015) (10)
- Using a direct simulation Monte Carlo approach to model collisions in a buffer gas cell. (2017) (9)
- Close coupling results for inelastic collisions of NH3 and Ar. A stringent test of a spectroscopic potential. (1994) (9)
- Rotationally Inelastic Scattering of Quantum-State-Selected ND3 with Ar. (2015) (9)
- State-to-State Differential Cross Sections for Inelastic Collisions of NO Radicals with para-H2 and ortho-D2 (2017) (9)
- A theoretical and experimental study of pressure broadening of the oxygen A-band by helium. (2014) (9)
- The water-carbon monoxide dimer: new infrared spectra, ab initio rovibrational energy level calculations, and an interesting in-termolecular mode. (2019) (8)
- Bound state spectroscopy of NH-He. (2004) (8)
- Isotope effects in the CO dimer: millimeter wave spectrum and rovibrational calculations of (12C18O)2. (2006) (8)
- Theoretical study of the He-HF+ complex. I. The two asymptotically degenerate ground state potential energy surfaces. (2004) (8)
- Ab initio treatment of the chemical reaction precursor complex Cl(2P)-HF. 2. Bound states and infrared spectrum. (2006) (8)
- Direct observation of product-pair correlations in rotationally inelastic collisions of ND3 with D2. (2019) (8)
- Rotational study of the NH3-CO complex: millimeter-wave measurements and ab initio calculations. (2015) (7)
- Quantum scattering calculations for ro-vibrational de-excitation of CO by hydrogen atoms. (2015) (7)
- Line-shape theory of the X3Σg-→a1Δg,b1Σg+ transitions in O2-O2 collision-induced absorption. (2017) (7)
- Rotational-vibrational resonance states. (2020) (6)
- Vibrational predissociation dynamics of methane-Ar: an ab initio approach. (2001) (6)
- Correlated energy transfer in rotationally and spin-orbit inelastic collisions of NO(X2Π1/2, j = 1/2f) with O2(X3Σg-). (2018) (6)
- Experimental and theoretical investigation of the A 3pi-X 2sigma- transition of NH/D-Ne. (2005) (6)
- Molecular square dancing in CO-CO collisions (2020) (6)
- Theoretical study of the He-HF+ complex. II. Rovibronic states from coupled diabatic potential energy surfaces. (2004) (6)
- Potential energy surface and bound states of the H2O-HF complex. (2020) (5)
- Comment on "Communication: Benzene dimer--the free energy landscape" [J. Chem. Phys. 139, 201102 (2013)]. (2014) (5)
- Jahn-Teller effect in van der Waals complexes; Ar-C6H6 + and Ar-C6D6 +. (2004) (4)
- Ammonia dimer: extremely fluxional but still hydrogen bonded (2022) (4)
- Para‐ortho hydrogen conversion: Solving a 90‐year old mystery (2020) (4)
- Stark effect in the benzene dimer. (2013) (4)
- Molecules in confinement in clusters, quantum solvents and matrices: general discussion. (2018) (4)
- Glory scattering in deeply inelastic molecular collisions (2022) (4)
- Near infrared overtone (vOH = 2 ← 0) spectroscopy of Ne-H2O clusters. (2017) (4)
- Rovibrational laser jet-cooled spectroscopy of the NH3–Ar complex in the ν2 umbrella region of NH3: comparison between new infrared data and an ab initio calculated spectrum* (2018) (4)
- Mapping partial wave dynamics in scattering resonances by rotational de-excitation collisions (2021) (3)
- Nuclear spin/parity dependent spectroscopy and predissociation dynamics in vOH = 2 ← 0 overtone excited Ne-H2O clusters: Theory and experiment. (2017) (3)
- Experimental and theoretical investigation of resonances in low-energy NO-H2 collisions. (2020) (3)
- Correlations in rotational energy transfer for NO-D2 inelastic collisions. (2020) (3)
- Intermolecular dynamics of NH3-rare gas complexes in the ν2 umbrella region of NH3 investigated by rovibrational laser jet-cooled spectroscopy and ab initio calculations. (2021) (2)
- High resolution TDL spectroscopy of the Ar-CH4 complex. (2002) (2)
- Ab initio study of the O3-N2 complex: Potential energy surface and rovibrational states. (2021) (2)
- Imaging inelastic scattering of CO with argon: polarization dependent differential cross sections. (2019) (2)
- The He-H3 + complex. II. Infrared predissociation spectrum and energy term diagram. (2022) (2)
- Stark Interference of Electric and Magnetic Dipole Transitions in the A-X Band of OH. (2016) (2)
- Precise characterisation of isolated molecules: general discussion. (2018) (1)
- Erratum: "Hyperfine interactions and internal rotation in methanol" [J. Chem. Phys. 145, 244301 (2016)]. (2018) (1)
- Ab initio treatment of the chemical reaction precursor complex Br(2P)-HCN. 1. Adiabatic and diabatic potential surfaces. (2007) (1)
- Energy dependent parity-pair behavior in NO + He collisions. (2018) (1)
- Correction to Differential Cross Sections for State-to-State Collisions of NO(v = 10) in Near-Copropagating Beams. (2019) (1)
- The He-H3 + complex. I. Vibration-rotation-tunneling states and transition probabilities. (2022) (1)
- Ab initio potential energy surface and microwave spectrum of the NH3-N2 van der Waals complex. (2020) (1)
- Publisher Correction: O2−O2 and O2−N2 collision-induced absorption mechanisms unravelled (2018) (1)
- Correlated rotational excitations in NO-CO inelastic collisions. (2022) (1)
- Multi-channel distorted-wave Born approximation for rovibrational transition rates in molecular collisions. (2021) (0)
- VIBRATIONAL SPECTROSCOPY OF H2He+ and D2He+ (2021) (0)
- Rotational energy transfer in collisions of ammonia with rare gas atoms and H2 (2017) (0)
- Quantum-Chemical calculations revealing the effects of magnetic fields on methanol masers (2017) (0)
- Characterization of methanol as a magnetic field tracer in star-forming regions (2018) (0)
- Quantum dynamics of isolated molecules: general discussion. (2018) (0)
- Quantum state–resolved molecular dipolar collisions over four decades of energy (2023) (0)
- Concluding remarks. (2018) (0)
- Tomography of Feshbach resonance states (2022) (0)
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