Timothy Michael Korter

    19982019
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    Research Output 1998 2019

    • 97 Article
    • 11 Conference contribution
    • 1 Review article
    2019
    2 Citations (Scopus)

    Anomalous Temperature Dependence of the Lowest-Frequency Lattice Vibration in Crystalline γ-minobutyric Acid

    Dampf, S. J. & Korter, T. M., Mar 14 2019, In : Journal of Physical Chemistry A. 123, 10, p. 2058-2064 7 p.

    Research output: Contribution to journalArticle

    Lattice vibrations
    lattice vibrations
    gamma-Aminobutyric Acid
    Crystalline materials
    low frequencies

    Defining the origins of multiple emission/excitation in rhenium-bisthiazole complexes

    Azzarelli, N., Ponnala, S., Aguirre, A., Dampf, S. J., Davis, M. P., Ruggiero, M. T., Lopez Diaz, V., Babich, J. W., Coogan, M., Korter, T. M., Doyle, R. P. & Zubieta, J. A., Apr 1 2019, In : Inorganica Chimica Acta. 489, p. 301-309 9 p.

    Research output: Contribution to journalArticle

    Rhenium
    Thiazoles
    Putrescine
    rhenium
    Carbon Monoxide
    1 Citation (Scopus)

    Mapping the polymorphic transformation gateway vibration in crystalline 1,2,4,5-tetrabromobenzene

    Zaczek, A. J., Catalano, L., Naumov, P. & Korter, T. M., Jan 1 2019, In : Chemical Science. 10, 5, p. 1332-1341 10 p.

    Research output: Contribution to journalArticle

    Crystalline materials
    Polymorphism
    Phase transitions
    Potential energy surfaces
    Vibrational spectra
    1 Citation (Scopus)

    Terahertz Spectroscopy and Quantum Mechanical Simulations of Crystalline Copper-Containing Historical Pigments

    Kleist, E. M., Koch Dandolo, C. L., Guillet, J. P., Mounaix, P. & Korter, T. M., Feb 14 2019, In : Journal of Physical Chemistry A. 123, 6, p. 1225-1232 8 p.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    pigments
    Pigments
    Copper
    Crystalline materials
    2018
    6 Citations (Scopus)

    Methyl-rotation dynamics in metal-organic frameworks probed with terahertz spectroscopy

    Li, Q., Zaczek, A. J., Korter, T. M., Zeitler, J. A. & Ruggiero, M. T., Jan 1 2018, In : Chemical Communications. 54, 45, p. 5776-5779 4 p.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    Rotors
    Metals
    Point groups
    Cobalt
    2 Citations (Scopus)

    Optical properties of Meloxicam in the far-infrared spectral region

    Aytekin, Y. S., Köktürk, M., Zaczek, A., Korter, T. M., Heilweil, E. J. & Esenturk, O., Jan 1 2018, (Accepted/In press) In : Chemical Physics.

    Research output: Contribution to journalArticle

    meloxicam
    drugs
    Optical properties
    Infrared radiation
    optical properties
    4 Citations (Scopus)

    Revisiting the Thermodynamic Stability of Indomethacin Polymorphs with Low-Frequency Vibrational Spectroscopy and Quantum Mechanical Simulations

    Ruggiero, M. T., Sutton, J. J., Fraser-Miller, S. J., Zaczek, A. J., Korter, T. M., Gordon, K. C. & Zeitler, J. A., Nov 7 2018, In : Crystal Growth and Design. 18, 11, p. 6513-6520 8 p.

    Research output: Contribution to journalArticle

    Vibrational spectroscopy
    Polymorphism
    Indomethacin
    Drug products
    Thermodynamic stability

    Terahertz Spectroscopy and Quantum Mechanical Simulations of Crystalline Historical Pigments

    Kleist, E. M., Dandolo, C. L. K., Korter, T. M. & Mounaix, P., Oct 25 2018, 2018 43rd International Conference on Infrared Millimeter and Terahertz Waves, IRMMW-THz 2018. IEEE Computer Society, Vol. 2018-September. 8510333

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

    Terahertz spectroscopy
    Pigments
    Crystalline materials
    Lattice vibrations
    Experiments
    2017

    Characterization of crystalline muconic acid polymorphs

    Zaczek, A. J. & Korter, T. M., Oct 12 2017, 2017 42nd International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz 2017. IEEE Computer Society, 8067033

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

    Polymorphism
    Crystalline materials
    Acids
    Terahertz spectroscopy
    Isomerization

    Comparison of Intermolecular Forces in Anhydrous Sorbitol and Solvent Cocrystals

    Dierks, T. M. & Korter, T. M., Aug 3 2017, In : Journal of Physical Chemistry A. 121, 30, p. 5720-5727 8 p.

    Research output: Contribution to journalArticle

    intermolecular forces
    Sorbitol
    mannitol
    water
    Water
    4 Citations (Scopus)

    Concomitant polymorphism and the martensitic-like transformation of an organic crystal

    Ruggiero, M. T., Axel Zeitler, J. & Korter, T. M., 2017, In : Physical Chemistry Chemical Physics. 19, 42, p. 28502-28506 5 p.

    Research output: Contribution to journalArticle

    polymorphism
    martensitic transformation
    Polymorphism
    Crystals
    coordinate transformations
    4 Citations (Scopus)

    Distinguishing Quinacridone Pigments via Terahertz Spectroscopy: Absorption Experiments and Solid-State Density Functional Theory Simulations

    Squires, A. D., Lewis, R. A., Zaczek, A. J. & Korter, T. M., May 11 2017, In : Journal of Physical Chemistry A. 121, 18, p. 3423-3429 7 p.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    pigments
    Pigments
    Density functional theory
    absorption spectroscopy
    2 Citations (Scopus)

    Quantification of cation-anion interactions in crystalline monopotassium and monosodium glutamate salts

    Ruggiero, M. T., Sibik, J., Erba, A., Zeitler, J. A. & Korter, T. M., 2017, In : Physical Chemistry Chemical Physics. 19, 42, p. 28647-28652 6 p.

    Research output: Contribution to journalArticle

    Sodium Glutamate
    glutamates
    Anions
    Cations
    Salts

    Terahertz spectroscopy of vibrational anharmonicity in crystalline γ-aminobutyric acid

    Dampf, S. J. & Korter, T. M., Oct 12 2017, 2017 42nd International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz 2017. IEEE Computer Society, 8067029

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

    Terahertz spectroscopy
    Potential energy surfaces
    Crystalline materials
    Specific heat
    Acids
    307 Citations (Scopus)

    The 2017 terahertz science and technology roadmap

    Dhillon, S. S., Vitiello, M. S., Linfield, E. H., Davies, A. G., Hoffmann, M. C., Booske, J., Paoloni, C., Gensch, M., Weightman, P., Williams, G. P., Castro-Camus, E., Cumming, D. R. S., Simoens, F., Escorcia-Carranza, I., Grant, J., Lucyszyn, S., Kuwata-Gonokami, M., Konishi, K., Koch, M., Schmuttenmaer, C. A. & 26 others, Cocker, T. L., Huber, R., Markelz, A. G., Taylor, Z. D., Wallace, V. P., Axel Zeitler, J., Sibik, J., Korter, T. M., Ellison, B., Rea, S., Goldsmith, P., Cooper, K. B., Appleby, R., Pardo, D., Huggard, P. G., Krozer, V., Shams, H., Fice, M., Renaud, C., Seeds, A., Stöhr, A., Naftaly, M., Ridler, N., Clarke, R., Cunningham, J. E. & Johnston, M. B., Feb 2 2017, In : Journal of Physics D: Applied Physics. 50, 4, 043001.

    Research output: Contribution to journalReview article

    Radiation
    emerging
    airport security
    radiation
    Airport security
    17 Citations (Scopus)

    The significance of the amorphous potential energy landscape for dictating glassy dynamics and driving solid-state crystallisation

    Ruggiero, M. T., Krynski, M., Kissi, E. O., Sibik, J., Markl, D., Tan, N. Y., Arslanov, D., Van Der Zande, W., Redlich, B., Korter, T. M., Grohganz, H., Löbmann, K., Rades, T., Elliott, S. R. & Zeitler, J. A., Jan 1 2017, In : Physical Chemistry Chemical Physics. 19, 44, p. 30039-30047 9 p.

    Research output: Contribution to journalArticle

    Crystallization
    Potential energy
    potential energy
    Potential energy surfaces
    crystallization
    2016
    8 Citations (Scopus)

    Evaluation of Range-Corrected Density Functionals for the Simulation of Pyridinium-Containing Molecular Crystals

    Ruggiero, M. T., Gooch, J., Zubieta, J. A. & Korter, T. M., Feb 18 2016, In : Journal of Physical Chemistry A. 120, 6, p. 939-947 9 p.

    Research output: Contribution to journalArticle

    Molecular crystals
    Potential energy surfaces
    Gaging
    functionals
    Density functional theory
    13 Citations (Scopus)

    Examination of l -Glutamic Acid Polymorphs by Solid-State Density Functional Theory and Terahertz Spectroscopy

    Ruggiero, M. T., Sibik, J., Zeitler, J. A. & Korter, T. M., Sep 29 2016, In : Journal of Physical Chemistry A. 120, 38, p. 7490-7495 6 p.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    glutamic acid
    Polymorphism
    Density functional theory
    Glutamic Acid

    Measuring protein elasticity with terahertz spectroscopy

    Ruggiero, M. T. & Korter, T. M., Nov 28 2016, 41st International Conference on Infrared, Millimeter and Terahertz Waves, IRMMW-THz 2016. IEEE Computer Society, Vol. 2016-November. 7758346

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

    Terahertz spectroscopy
    Polypeptides
    Elasticity
    Proteins
    Biopolymers
    14 Citations (Scopus)

    Measuring the Elasticity of Poly-l-Proline Helices with Terahertz Spectroscopy

    Ruggiero, M. T., Sibik, J., Orlando, R., Zeitler, J. A. & Korter, T. M., 2016, (Accepted/In press) In : Angewandte Chemie - International Edition.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    Proline
    Elasticity
    Elastic moduli
    Rigidity
    5 Citations (Scopus)

    Origins of the relative stabilities of anhydrous and hydrated D-mannitol crystals

    Dierks, T. M. & Korter, T. M., Aug 25 2016, In : Journal of Physical Chemistry A. 120, 33, p. 6629-6636 8 p.

    Research output: Contribution to journalArticle

    mannitol
    Mannitol
    Polymorphism
    thermodynamics
    Crystals
    4 Citations (Scopus)

    The crucial role of water in shaping low-barrier hydrogen bonds

    Ruggiero, M. T. & Korter, T. M., 2016, In : Physical Chemistry Chemical Physics. 18, 7, p. 5521-5528 8 p.

    Research output: Contribution to journalArticle

    Hydrogen bonds
    Metals
    hydrogen bonds
    Water
    maleates
    2 Citations (Scopus)

    Uncovering the Terahertz Spectrum of Copper Sulfate Pentahydrate

    Ruggiero, M. T. & Korter, T. M., Jan 21 2016, In : Journal of Physical Chemistry A. 120, 2, p. 227-232 6 p.

    Research output: Contribution to journalArticle

    Copper Sulfate
    drying
    Sulfates
    sulfates
    Drying
    2015
    1 Citation (Scopus)

    Combined infrared and terahertz analysis of amorphous sorbitol

    Sibik, J., Korter, T. M. & Zeitler, J. A., Nov 11 2015, IRMMW-THz 2015 - 40th International Conference on Infrared, Millimeter, and Terahertz Waves. Institute of Electrical and Electronics Engineers Inc., 7327729

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

    Infrared radiation
    amorphous materials
    glass transition temperature
    Density functional theory
    Molecular dynamics

    Computations on the primary photoreaction of Br2 with CO2: Stepwise vs concerted addition of Br atoms

    Xu, K., Korter, T. M. & Braiman, M. S., Apr 9 2015, In : Journal of Physical Chemistry A. 119, 14, p. 3348-3354 7 p.

    Research output: Contribution to journalArticle

    Atoms
    Geometry
    Photochemical reactions
    geometry
    Binding energy
    1 Citation (Scopus)

    Investigation of the terahertz vibrational modes of ZIF-8 and ZIF-90 with terahertz time-domain spectroscopy

    Tan, N. Y., Ruggiero, M. T., Orellana, C., Tian, T., Bond, A. D., Korter, T. M., Fairen-Jimenez, D. & Zeitler, J. A., Nov 11 2015, IRMMW-THz 2015 - 40th International Conference on Infrared, Millimeter, and Terahertz Waves. Institute of Electrical and Electronics Engineers Inc., 7327716

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

    vibration mode
    Spectroscopy
    spectroscopy
    interactions
    Temperature
    19 Citations (Scopus)

    Investigation of the terahertz vibrational modes of ZIF-8 and ZIF-90 with terahertz time-domain spectroscopy

    Tan, N. Y., Ruggiero, M. T., Orellana-Tavra, C., Tian, T., Bond, A. D., Korter, T. M., Fairen-Jimenez, D. & Axel Zeitler, J., 2015, In : Chemical Communications. 51, 89, p. 16037-16040 4 p.

    Research output: Contribution to journalArticle

    Lattice vibrations
    Dynamic analysis
    Crystal structure
    Gases
    Spectroscopy
    10 Citations (Scopus)

    Origins of contrasting copper coordination geometries in crystalline copper sulfate pentahydrate

    Ruggiero, M. T., Erba, A., Orlando, R. & Korter, T. M., 2015, In : Physical Chemistry Chemical Physics. 17, 46, p. 31023-31029 7 p.

    Research output: Contribution to journalArticle

    Copper Sulfate
    Copper
    sulfates
    Metals
    Crystalline materials
    5 Citations (Scopus)

    Origins of hydration differences in homochiral and racemic crystals of aspartic acid

    Juliano, T. R. & Korter, T. M., Feb 26 2015, In : Journal of Physical Chemistry A. 119, 8, p. 1396-1403 8 p.

    Research output: Contribution to journalArticle

    aspartic acid
    Aspartic Acid
    Hydration
    hydration
    Crystals
    12 Citations (Scopus)

    Piezo-optic tensor of crystals from quantum-mechanical calculations

    Erba, A., Ruggiero, M. T., Korter, T. M. & Dovesi, R., Oct 14 2015, In : The Journal of Chemical Physics. 143, 14, 144504.

    Research output: Contribution to journalArticle

    Tensors
    Optics
    tensors
    optics
    Derivatives
    15 Citations (Scopus)

    Terahertz disorder-localized rotational modes and lattice vibrational modes in the orientationally-disordered and ordered phases of camphor

    Nickel, D. V., Ruggiero, M. T., Korter, T. M. & Mittleman, D. M., Mar 14 2015, In : Physical Chemistry Chemical Physics. 17, 10, p. 6734-6740 7 p.

    Research output: Contribution to journalArticle

    Camphor
    camphor
    Discrete Fourier transforms
    vibration mode
    disorders
    17 Citations (Scopus)

    Terahertz Spectroscopy and Computational Investigation of the Flufenamic Acid/Nicotinamide Cocrystal

    Delaney, S. P. & Korter, T. M., Apr 2 2015, In : Journal of Physical Chemistry A. 119, 13, p. 3269-3276 8 p.

    Research output: Contribution to journalArticle

    Flufenamic Acid
    Terahertz spectroscopy
    nicotinamide
    Niacinamide
    solid state
    10 Citations (Scopus)

    The role of terahertz polariton absorption in the characterization of crystalline iron sulfate hydrates

    Ruggiero, M. T., Bardon, T., Strlič, M., Taday, P. F. & Korter, T. M., Apr 14 2015, In : Physical Chemistry Chemical Physics. 17, 14, p. 9326-9334 9 p.

    Research output: Contribution to journalArticle

    Hydrates
    hydrates
    polaritons
    Sulfates
    sulfates
    2014
    10 Citations (Scopus)

    Assignment of the terahertz spectra of crystalline copper sulfate and its hydrates via solid-state density functional theory

    Ruggiero, M. T., Bardon, T., Strlič, M., Taday, P. F. & Korter, T. M., Oct 30 2014, In : Journal of Physical Chemistry A. 118, 43, p. 10101-10108 8 p.

    Research output: Contribution to journalArticle

    Copper Sulfate
    Hydrates
    hydrates
    Density functional theory
    sulfates
    14 Citations (Scopus)

    Conformational origins of polymorphism in two forms of flufenamic acid

    Delaney, S. P., Smith, T. M. & Korter, T. M., 2014, In : Journal of Molecular Structure. 1078, p. 83-89 7 p.

    Research output: Contribution to journalArticle

    Flufenamic Acid
    Polymorphism
    Terahertz spectroscopy
    Density functional theory
    Conformations
    6 Citations (Scopus)

    Conformation versus cohesion in the relative stabilities of gabapentin polymorphs

    Delaney, S. P., Smith, T. M. & Korter, T. M., 2014, In : RSC Advances. 4, 2, p. 855-864 10 p.

    Research output: Contribution to journalArticle

    Polymorphism
    Conformations
    Terahertz spectroscopy
    Binding energy
    Drug products
    1 Citation (Scopus)

    Crystal structure and terahertz spectroscopy of α,α,α', α'-tetrabromo-p-xylene modeled using solid-state density functional theory

    Pellizzeri, S., Smith, T. M., Delaney, S. P., Korter, T. M. & Zubieta, J. A., Jan 24 2014, In : Journal of Molecular Structure. 1058, 1, p. 265-271 7 p.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    Density functional theory
    Crystal structure
    Molecular vibrations
    Molecular crystals
    5 Citations (Scopus)

    London force correction disparity in the modeling of crystalline asparagine and glutamine

    Juliano, T. R. & Korter, T. M., Dec 26 2014, In : Journal of Physical Chemistry A. 118, 51, p. 12221-12228 8 p.

    Research output: Contribution to journalArticle

    glutamine
    Asparagine
    Glutamine
    Crystalline materials
    Density functional theory
    14 Citations (Scopus)

    Low-temperature phase transition in crystalline aripiprazole leads to an eighth polymorph

    Delaney, S. P., Smith, T. M., Pan, D., Yin, S. X. & Korter, T. M., Oct 1 2014, In : Crystal Growth and Design. 14, 10, p. 5004-5010 7 p.

    Research output: Contribution to journalArticle

    Polymorphism
    Phase transitions
    Crystalline materials
    organic solids
    Flufenamic Acid
    18 Citations (Scopus)

    Terahertz vibrational modes of the rigid crystal phase of succinonitrile

    Nickel, D. V., Delaney, S. P., Bian, H., Zheng, J., Korter, T. M. & Mittleman, D. M., Apr 3 2014, In : Journal of Physical Chemistry A. 118, 13, p. 2442-2446 5 p.

    Research output: Contribution to journalArticle

    succinonitrile
    vibration mode
    Crystals
    plastics
    disorders
    9 Citations (Scopus)

    Using terahertz spectroscopy and solid-state density functional theory to characterize a new polymorph of 5-(4-pyridyl)tetrazole

    Pellizzeri, S., Delaney, S. P., Korter, T. M. & Zubieta, J. A., Jan 16 2014, In : Journal of Physical Chemistry A. 118, 2, p. 417-426 10 p.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    tetrazoles
    Polymorphism
    Density functional theory
    density functional theory
    2013
    4 Citations (Scopus)
    Density functional theory
    Substitution reactions
    Metals
    Manganese
    Cobalt
    12 Citations (Scopus)

    Evaluating london dispersion force corrections in crystalline nitroguanidine by terahertz spectroscopy

    Juliano, T. R., King, M. D. & Korter, T. M., 2013, In : IEEE Transactions on Terahertz Science and Technology. 3, 3, p. 281-287 7 p., 6502295.

    Research output: Contribution to journalArticle

    nitroguanidine
    Terahertz spectroscopy
    Crystalline materials
    spectroscopy
    solid state
    25 Citations (Scopus)

    Evaluating the roles of conformational strain and cohesive binding in crystalline polymorphs of aripiprazole

    Delaney, S. P., Pan, D., Yin, S. X., Smith, T. M. & Korter, T. M., Jul 3 2013, In : Crystal Growth and Design. 13, 7, p. 2943-2952 10 p.

    Research output: Contribution to journalArticle

    Crystallization
    Polymorphism
    Crystalline materials
    solid state
    Density functional theory
    13 Citations (Scopus)

    Terahertz vibrations of crystalline acyclic and cyclic diglycine: Benchmarks for London force correction models

    Juliano, T. R. & Korter, T. M., Oct 10 2013, In : Journal of Physical Chemistry A. 117, 40, p. 10504-10512 9 p.

    Research output: Contribution to journalArticle

    Glycylglycine
    intermolecular forces
    density functional theory
    Crystalline materials
    vibration
    11 Citations (Scopus)
    Terahertz spectroscopy
    Density functional theory
    Anions
    Salts
    Molecular vibrations
    2012
    12 Citations (Scopus)

    Improved mode assignment for molecular crystals through anisotropic terahertz spectroscopy

    Singh, R., George, D. K., Benedict, J. B., Korter, T. M. & Markelz, A. G., Oct 25 2012, In : Journal of Physical Chemistry A. 116, 42, p. 10359-10364 6 p.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    Molecular crystals
    sucrose
    Sucrose
    Oxalic Acid
    25 Citations (Scopus)

    Investigating tautomeric polymorphism in crystalline anthranilic acid using terahertz spectroscopy and solid-state density functional theory

    Delaney, S. P., Witko, E. M., Smith, T. M. & Korter, T. M., Aug 2 2012, In : Journal of Physical Chemistry A. 116, 30, p. 8051-8057 7 p.

    Research output: Contribution to journalArticle

    Terahertz spectroscopy
    polymorphism
    Polymorphism
    Density functional theory
    zwitterions
    17 Citations (Scopus)
    Molecular crystals
    Lattice vibrations
    Density functional theory
    density functional theory
    solid state
    22 Citations (Scopus)

    Revealing the true crystal structure of L-phenylalanine using solid-state density functional theory

    King, M. D., Blanton, T. N. & Korter, T. M., Jan 21 2012, In : Physical Chemistry Chemical Physics. 14, 3, p. 1113-1116 4 p.

    Research output: Contribution to journalArticle

    Molecular crystals
    phenylalanine
    Phenylalanine
    X ray powder diffraction
    Density functional theory