Publications

Murdoch KM, Ferris TD, Wright JC, Farrar TC. Infrared spectroscopy of ethanol clusters in ethanol-hexane binary solutions. Journal of Chemical Physics. 2002;116:5717-5724.
Hansen MJ, Wendt MA, Weinhold F, Farrar TC. Experimental and theoretical spin-spin coupling constants for N-15 formamide. Molecular Physics. 2002;100:2807-2814.
Ropp J, Lawrence C, Farrar TC, Skinner JL. Rotational motion in liquid water is anisotropic: A nuclear magnetic resonance and molecular dynamics simulation study. Journal of the American Chemical Society. 2001;123:8047-8052.
Ferris TD, Zeidler MD, Farrar TC. The concentration dependence of the proton chemical shift and the deuterium quadrupole coupling parameter for binary solutions of ethanol. Molecular Physics. 2000;98:737-744.
Ludwig R, Weinhold F, Farrar TC. Quantum cluster equilibrium theory of liquids: temperature dependent chemical shifts, quadrupole coupling constants and vibrational frequencies in liquid ethanol. Molecular Physics. 1999;97:479-486.
Ludwig R, Weinhold F, Farrar TC. Quantum cluster equilibrium theory of liquids: molecular clusters and thermodynamics of liquid ethanol. Molecular Physics. 1999;97:465-477.
Wendt MA, Weinhold F, Farrar TC. Critical test of quantum cluster equilibrium theory: Formic acid at B3LYP/6-31+G* hybrid density functional level. Journal of Chemical Physics. 1998;109:5945-5947.
Wendt MA, Meiler J, Weinhold F, Farrar TC. Solvent and concentration dependence of the hydroxyl chemical shift of methanol. Molecular Physics. 1998;93:145-151.
Ludwig R, Weinhold F, Farrar TC. Quantum cluster equilibrium theory of liquids part II: Temperature dependent chemical shifts, quadrupole coupling constants and vibrational frequencies in liquid ammonia. Berichte Der Bunsen-Gesellschaft-Physical Chemistry Chemical Physics. 1998;102:205-212.
Ludwig R, Weinhold F, Farrar TC. Quantum cluster equilibrium theory of liquids part I: Molecular clusters and thermodynamics of liquid ammonia. Berichte Der Bunsen-Gesellschaft-Physical Chemistry Chemical Physics. 1998;102:197-204.
Ludwig R, Reis O, Winter R, Weinhold F, Farrar TC. Quantum cluster equilibrium theory of liquids: Temperature dependence of hydrogen bonding in liquid N-methylacetamide studied by IR spectra. Journal of Physical Chemistry B. 1998;102:9312-9318.
Ludwig R, Weinhold F, Farrar TC. Theoretical study of hydrogen bonding in liquid and gaseous N-methylformamide. Journal of Chemical Physics. 1997;107:499-507.
Ludwig R, Weinhold F, Farrar TC. Structure of liquid N-methylacetamide: Temperature dependence of NMR chemical shifts and quadrupole coupling constants. Journal of Physical Chemistry A. 1997;101:8861-8870.
Bohmann JA, Weinhold F, Farrar TC. Natural chemical shielding analysis of nuclear magnetic resonance shielding tensors from gauge-including atomic orbital calculations. Journal of Chemical Physics. 1997;107:1173-1184.
Ludwig R, Weinhold F, Farrar TC. Effective O-17 quadrupole moments for the calibrated computation of quadrupole coupling parameters at different levels of theory. Journal of Chemical Physics. 1996;105:8223-8230.
Ludwig R, Weinhold F, Farrar TC. EXPERIMENTAL AND THEORETICAL-STUDIES OF HYDROGEN-BONDING IN NEAT, LIQUID FORMAMIDE. Journal of Chemical Physics. 1995;102:5118-5125.
Ludwig R, Weinhold F, Farrar TC. TEMPERATURE-DEPENDENCE OF HYDROGEN-BONDING IN NEAT, LIQUID FORMAMIDE. Journal of Chemical Physics. 1995;103:3636-3642.
Ludwig R, Weinhold F, Farrar TC. EXPERIMENTAL AND THEORETICAL DETERMINATION OF THE TEMPERATURE-DEPENDENCE OF DEUTERON AND OXYGEN QUADRUPOLE COUPLING-CONSTANTS OF LIQUID WATER. Journal of Chemical Physics. 1995;103:6941-6950.
King BF, Farrar TC, Weinhold F. QUADRUPOLE COUPLING-CONSTANTS IN LINEAR (HCN)(N) CLUSTERS - THEORETICAL AND EXPERIMENTAL-EVIDENCE FOR COOPERATIVITY EFFECTS IN C-H-CENTER-DOT-CENTER-DOT-CENTER-DOT-N HYDROGEN-BONDING. Journal of Chemical Physics. 1995;103:348-352.
Trudeau JD, Schwartz JL, Farrar TC. ABINITIO CALCULATIONS AND EXPERIMENTAL-MEASUREMENT OF THE DEUTERIUM QUADRUPOLE COUPLING-CONSTANT IN NA2PDO3. Journal of Physical Chemistry. 1991;95:9788-9791.
Richey B, Lewis BA, Anderson CF, Farrar TC, Record MT. STUDIES ON THE EXTENT OF NMR VISIBILITY OF NA-23 AND K-39 IN SOLUTIONS AND GELS OF POLYELECTROLYTES. Biophysical Journal. 1987;51:A73-A73.
Richey B, Cayley DS, Mossing MC, Kolka C, Anderson CF, Farrar TC, et al.. VARIABILITY OF THE INTRACELLULAR IONIC ENVIRONMENT OF ESCHERICHIA-COLI - DIFFERENCES BETWEEN INVITRO AND INVIVO EFFECTS OF ION CONCENTRATIONS ON PROTEIN-DNA INTERACTIONS AND GENE-EXPRESSION. Journal of Biological Chemistry. 1987;262:7157-7164.