J. H. van Lenthe

发表

A space‐saving modification of Davidson's eigenvector algorithm

J. H. van Lenthe, P. Pulay, J. H. Van Lenthe, 1990 .

An improvement of Davidson's iteration method: Applications to MRCI and MRCEPA calculations

H.J.J. Van Dam, J.H. Van Lenthe, G.L.G. Sleijpen, 1996 .

SYNOPSIS: SYNthesize and OPtimize System in Silico.

H. M. Vinkers, J. H. van Lenthe, F. Daeyaert, 2003, Journal of medicinal chemistry.

The GAMESS-UK electronic structure package: algorithms, developments and applications

Ian J. Bush, Paul Sherwood, Remco W. A. Havenith, 2005 .

On the interpretation of valence bond wavefunctions.

J. H. van Lenthe, R. Havenith, L. W. Jenneskens, 2007, Faraday discussions.

Weak distance dependence of through-bond interactions in tetrahydro-4H-thiopyran-4-ylidene end-capped oligo(cyclohexylidenes); a computational survey.

J. H. van Lenthe, R. Havenith, L. W. Jenneskens, 2007, Physical chemistry chemical physics : PCCP.

A theoretical study on the metabolic activation of paracetamol by cytochrome P-450: indications for a uniform oxidation mechanism.

J. H. van Lenthe, L. Koymans, N. Vermeulen, 1988, Chemical research in toxicology.

Magnetic properties and aromaticity of o-, m-, and p-benzyne.

J. H. van Lenthe, P. Geerlings, F. De Proft, 2002, Chemistry.

Prediction of prognosis in patients with left ventricular dysfunction using three-dimensional strain echocardiography and cardiac magnetic resonance imaging

J. H. van Lenthe, O. Kamp, A. Beek, 2022, Netherlands Heart Journal.

Spin coupling and resonance.

J. H. van Lenthe, M. Zieliński, 2008, The journal of physical chemistry. A.

Stability and aromaticity of the cyclopenta-fused pyrene congeners.

J. H. van Lenthe, P. Schleyer, L. T. Scott, 2002, Journal of the American Chemical Society.

Ab initio calculation of the NH(3sigma-)-NH(3sigma-) interaction potentials in the quintet, triplet, and singlet states.

J. H. van Lenthe, G. Groenenboom, A. van der Avoird, 2005, The Journal of chemical physics.

Assignment of phantom bands in the solid-state infrared and Raman spectra of coronene: The importance of a minute out-of-plane distortion.

J. H. van Lenthe, L. W. Jenneskens, P. Todorov, 2010, The Journal of chemical physics.

1H,1H,2H,2H-perfluoroalkyl-functionalization of Ni(II), Pd(II), and Pt(II) mono- and diphosphine complexes: minimizing the electronic consequences for the metal center.

J. H. van Lenthe, G. van Koten, L. W. Jenneskens, 2003, Inorganic chemistry.

Metal-to-ligand electron transfer in diiminopyridine complexes of Mn-Zn. A theoretical study.

J. H. van Lenthe, K. Wieghardt, B. de Bruin, 2001, Inorganic chemistry.

SO2-binding properties of cationic η6,η1-NCN-pincer arene ruthenium platinum complexes: spectroscopic and theoretical studies.

J. H. van Lenthe, G. van Koten, H. V. van Dam, 2011, Dalton transactions.

Metabolite predictions for para-substituted anisoles based on ab initio complete active space self-consistent field calculations.

J. H. van Lenthe, N. Vermeulen, M. D. de Groot, 1995, Chemical research in toxicology.

N-acetylmethionine and biotin as photocleavable protective groups for ruthenium polypyridyl complexes.

J. H. van Lenthe, S. Bonnet, M. Siegler, 2011, Chemistry.

The electronic structure of inorganic benzenes: valence bond and ring-current descriptions.

J. H. van Lenthe, P. Fowler, R. Havenith, 2005, Inorganic chemistry.

Rydberg-valence interactions in monoolefins: dispersing electronic properties in 1,1'-bicyclohexylidene.

J. H. van Lenthe, W. Buma, L. W. Jenneskens, 2003, Chemphyschem : a European journal of chemical physics and physical chemistry.

A unified orbital model of delocalised and localised currents in monocycles, from annulenes to azabora-heterocycles.

J. H. van Lenthe, P. Fowler, A. Soncini, 2005, Chemistry.

Multireference coupled electron-pair approximations to the multireference coupled cluster method. The MR-CEPA1 method

J. H. van Lenthe, P. Todorov, P. J. A. Ruttink †, 2005 .

Resonance and aromaticity: an ab initio valence bond approach.

J. H. van Lenthe, R. Havenith, Z. Rashid, 2012, The journal of physical chemistry. A.

Hydrogen storage in magnesium clusters: quantum chemical study.

J. H. van Lenthe, P. D. de Jongh, K. D. de Jong, 2005, Journal of the American Chemical Society.

Chemical and quantum mechanical studies of the free radical C-C bond formation in the lipoxygenase-catalyzed dimerisation of octodeca-9,12-diynoic acid.

J. H. van Lenthe, J. Vliegenthart, G. Veldink, 1997, Free radical biology & medicine.

A quadratically convergent VBSCF method.

J. H. van Lenthe, Joop H van Lenthe, Zahid Rashid, 2013, The Journal of chemical physics.

Zinc coordination to the bapbpy ligand in homogeneous solutions and at liposomes: zinc detection via fluorescence enhancement.

J. H. van Lenthe, L. De Cola, M. Lutz, 2013, Dalton transactions.

Prediction of prognosis in patients with left ventricular dysfunction using three-dimensional strain echocardiography and cardiac magnetic resonance imaging

J. H. van Lenthe, O. Kamp, A. Beek, 2022, Netherlands Heart Journal.