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Disambiguation of "Thiel, W."

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A nonlocal correlation energy density functional from a Coulomb hole model

, and . INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 62 (6): 603--616 (1997)

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Verena Thiel

Charakterisierung chemischer Signalstoffe aus Bakterien. TU Braunschweig, (2009)

W Müller

W Löwa

W Voigt

W Warsch

 

Other publications of authors with the same name

QM/MM free-energy perturbation compared to thermodynamic integration and umbrella sampling: Application to an enzymatic reaction, , , , and . JOURNAL OF CHEMICAL THEORY AND COMPUTATION, (March 2006)Perspectives on semiempirical molecular orbital theory. ADVANCES IN CHEMICAL PHYSICS, VOL XCIII, (1996)A nonlocal correlation energy density functional from a Coulomb hole model, and . INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 62 (6): 603--616 (1997)QM/MM methods for biomolecular systems, and . Angew. Chem. Int. Ed. Engl., (2009)Benchmarks for electronically excited states: CASPT2, CC2, CCSD, and CC3, , , and . J.\,Chem.\,Phys., (2008)Enzymatic reactions of triosephosphate isomerase: A theoretical calibration study, , , and . JOURNAL OF PHYSICAL CHEMISTRY B, 106 (7): 1758--1767 (2002)Anharmonic force fields from density functional theory, and . CHEMICAL PHYSICS LETTERS, 273 (1-2): 71--78 (1997)Semiempirical treatment of electrostatic potentials and partial charges in combined quantum mechanical and molecular mechanical approaches, and . JOURNAL OF COMPUTATIONAL CHEMISTRY, 17 (1): 87--108 (1996)Adjusted connection atoms for combined quantum mechanical and molecular mechanical methods, and . JOURNAL OF PHYSICAL CHEMISTRY A, 103 (46): 9290--9295 (1999)Benchmarks for electronically excited states: Time-dependent density functional theory and density functional theory based multireference configuration interaction, , , and . J.\,Chem.\,Phys., (2008)