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Highly functionalized organic nitrates in the southeast United States: Contribution to secondary organic aerosol and reactive nitrogen budgets.

Proceedings of the National Academy of Sciences of the United States of America

Lee BH, Mohr C, Lopez-Hilfiker FD, Lutz A, Hallquist M, Lee L, Romer P, Cohen RC, Iyer S, Kurtén T, Hu W, Day DA, Campuzano-Jost P, Jimenez JL, Xu L, Ng NL, Guo H, Weber RJ, Wild RJ, Brown SS, Koss A, de Gouw J, Olson K, Goldstein AH, Seco R, Kim S, McAvey K, Shepson PB, Starn T, Baumann K, Edgerton ES, Liu J, Shilling JE, Miller DO, Brune W, Schobesberger S, D'Ambro EL, Thornton JA.
PMID: 26811465
Proc Natl Acad Sci U S A. 2016 Feb 09;113(6):1516-21. doi: 10.1073/pnas.1508108113. Epub 2016 Jan 25.

Speciated particle-phase organic nitrates (pONs) were quantified using online chemical ionization MS during June and July of 2013 in rural Alabama as part of the Southern Oxidant and Aerosol Study. A large fraction of pONs is highly functionalized, possessing...

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Lee BH, Mohr C, Lopez-Hilfiker FD, et al. Highly functionalized organic nitrates in the southeast United States: Contribution to secondary organic aerosol and reactive nitrogen budgets. Proc Natl Acad Sci U S A. 2016;113(6):1516-21doi: 10.1073/pnas.1508108113.
Lee, B. H., Mohr, C., Lopez-Hilfiker, F. D., Lutz, A., Hallquist, M., Lee, L., Romer, P., Cohen, R. C., Iyer, S., Kurtén, T., Hu, W., Day, D. A., Campuzano-Jost, P., Jimenez, J. L., Xu, L., Ng, N. L., Guo, H., Weber, R. J., Wild, R. J., Brown, S. S., Koss, A., de Gouw, J., Olson, K., Goldstein, A. H., Seco, R., Kim, S., McAvey, K., Shepson, P. B., Starn, T., Baumann, K., Edgerton, E. S., Liu, J., Shilling, J. E., Miller, D. O., Brune, W., Schobesberger, S., D'Ambro, E. L., & Thornton, J. A. (2016). Highly functionalized organic nitrates in the southeast United States: Contribution to secondary organic aerosol and reactive nitrogen budgets. Proceedings of the National Academy of Sciences of the United States of America, 113(6), 1516-21. https://doi.org/10.1073/pnas.1508108113
Lee, Ben H, et al. "Highly functionalized organic nitrates in the southeast United States: Contribution to secondary organic aerosol and reactive nitrogen budgets." Proceedings of the National Academy of Sciences of the United States of America vol. 113,6 (2016): 1516-21. doi: https://doi.org/10.1073/pnas.1508108113
Lee BH, Mohr C, Lopez-Hilfiker FD, Lutz A, Hallquist M, Lee L, Romer P, Cohen RC, Iyer S, Kurtén T, Hu W, Day DA, Campuzano-Jost P, Jimenez JL, Xu L, Ng NL, Guo H, Weber RJ, Wild RJ, Brown SS, Koss A, de Gouw J, Olson K, Goldstein AH, Seco R, Kim S, McAvey K, Shepson PB, Starn T, Baumann K, Edgerton ES, Liu J, Shilling JE, Miller DO, Brune W, Schobesberger S, D'Ambro EL, Thornton JA. Highly functionalized organic nitrates in the southeast United States: Contribution to secondary organic aerosol and reactive nitrogen budgets. Proc Natl Acad Sci U S A. 2016 Feb 09;113(6):1516-21. doi: 10.1073/pnas.1508108113. Epub 2016 Jan 25. PMID: 26811465; PMCID: PMC4760802.
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Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid.

The journal of physical chemistry. A

Elm J, Myllys N, Hyttinen N, Kurtén T.
PMID: 26154271
J Phys Chem A. 2015 Jul 30;119(30):8414-21. doi: 10.1021/acs.jpca.5b04040. Epub 2015 Jul 21.

We investigate the molecular interactions between sulfuric acid and a recently reported C6H8O7 ketodiperoxy acid formed through autoxidation from cyclohexene and ozone. Structurally similar but larger ELVOC (extremely low volatility organic compound) products formed from autoxidation of monoterpenes are...

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Elm J, Myllys N, Hyttinen N, et al. Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid. J Phys Chem A. 2015;119(30):8414-21doi: 10.1021/acs.jpca.5b04040.
Elm, J., Myllys, N., Hyttinen, N., & Kurtén, T. (2015). Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid. The journal of physical chemistry. A, 119(30), 8414-21. https://doi.org/10.1021/acs.jpca.5b04040
Elm, Jonas, et al. "Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid." The journal of physical chemistry. A vol. 119,30 (2015): 8414-21. doi: https://doi.org/10.1021/acs.jpca.5b04040
Elm J, Myllys N, Hyttinen N, Kurtén T. Computational Study of the Clustering of a Cyclohexene Autoxidation Product C6H8O7 with Itself and Sulfuric Acid. J Phys Chem A. 2015 Jul 30;119(30):8414-21. doi: 10.1021/acs.jpca.5b04040. Epub 2015 Jul 21. PMID: 26154271.
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Benchmarking ab initio binding energies of hydrogen-bonded molecular clusters based on FTIR spectroscopy.

The journal of physical chemistry. A

Bork N, Du L, Reiman H, Kurtén T, Kjaergaard HG.
PMID: 24988143
J Phys Chem A. 2014 Jul 17;118(28):5316-22. doi: 10.1021/jp5037537. Epub 2014 Jul 02.

Models of formation and growth of atmospheric aerosols are highly dependent on accurate cluster binding energies. These are most often calculated by ab initio electronic structure methods but remain associated with significant uncertainties. We present a computational benchmarking study...

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Bork N, Du L, Reiman H, et al. Benchmarking ab initio binding energies of hydrogen-bonded molecular clusters based on FTIR spectroscopy. J Phys Chem A. 2014;118(28):5316-22doi: 10.1021/jp5037537.
Bork, N., Du, L., Reiman, H., Kurtén, T., & Kjaergaard, H. G. (2014). Benchmarking ab initio binding energies of hydrogen-bonded molecular clusters based on FTIR spectroscopy. The journal of physical chemistry. A, 118(28), 5316-22. https://doi.org/10.1021/jp5037537
Bork, Nicolai, et al. "Benchmarking ab initio binding energies of hydrogen-bonded molecular clusters based on FTIR spectroscopy." The journal of physical chemistry. A vol. 118,28 (2014): 5316-22. doi: https://doi.org/10.1021/jp5037537
Bork N, Du L, Reiman H, Kurtén T, Kjaergaard HG. Benchmarking ab initio binding energies of hydrogen-bonded molecular clusters based on FTIR spectroscopy. J Phys Chem A. 2014 Jul 17;118(28):5316-22. doi: 10.1021/jp5037537. Epub 2014 Jul 02. PMID: 24988143.
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Atmospheric fate of methyl vinyl ketone: peroxy radical reactions with NO and HO2.

The journal of physical chemistry. A

Praske E, Crounse JD, Bates KH, Kurtén T, Kjaergaard HG, Wennberg PO.
PMID: 25486386
J Phys Chem A. 2015 May 14;119(19):4562-72. doi: 10.1021/jp5107058. Epub 2015 Jan 08.

First generation product yields from the OH-initiated oxidation of methyl vinyl ketone (3-buten-2-one, MVK) under both low and high NO conditions are reported. In the low NO chemistry, three distinct reaction channels are identified leading to the formation of...

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Praske E, Crounse JD, Bates KH, et al. Atmospheric fate of methyl vinyl ketone: peroxy radical reactions with NO and HO2. J Phys Chem A. 2015;119(19):4562-72doi: 10.1021/jp5107058.
Praske, E., Crounse, J. D., Bates, K. H., Kurtén, T., Kjaergaard, H. G., & Wennberg, P. O. (2015). Atmospheric fate of methyl vinyl ketone: peroxy radical reactions with NO and HO2. The journal of physical chemistry. A, 119(19), 4562-72. https://doi.org/10.1021/jp5107058
Praske, Eric, et al. "Atmospheric fate of methyl vinyl ketone: peroxy radical reactions with NO and HO2." The journal of physical chemistry. A vol. 119,19 (2015): 4562-72. doi: https://doi.org/10.1021/jp5107058
Praske E, Crounse JD, Bates KH, Kurtén T, Kjaergaard HG, Wennberg PO. Atmospheric fate of methyl vinyl ketone: peroxy radical reactions with NO and HO2. J Phys Chem A. 2015 May 14;119(19):4562-72. doi: 10.1021/jp5107058. Epub 2015 Jan 08. PMID: 25486386.
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Acid-Mediated Formation of Radicals or Baeyer-Villiger Oxidation from Criegee Adducts.

Angewandte Chemie (International ed. in English)

Schweitzer-Chaput B, Kurtén T, Klussmann M.
PMID: 26267787
Angew Chem Int Ed Engl. 2015 Sep 28;54(40):11848-51. doi: 10.1002/anie.201505648. Epub 2015 Aug 12.

The acid-mediated reaction of ketones with hydroperoxides generates radicals, a process with reaction conditions similar to those of the Baeyer-Villiger oxidation but with an outcome resembling the formation of hydroxyl radicals via ozonolysis in the atmosphere. The Baeyer-Villiger oxidation...

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Schweitzer-Chaput B, Kurtén T, Klussmann M. Acid-Mediated Formation of Radicals or Baeyer-Villiger Oxidation from Criegee Adducts. Angew Chem Int Ed Engl. 2015;54(40):11848-51doi: 10.1002/anie.201505648.
Schweitzer-Chaput, B., Kurtén, T., & Klussmann, M. (2015). Acid-Mediated Formation of Radicals or Baeyer-Villiger Oxidation from Criegee Adducts. Angewandte Chemie (International ed. in English), 54(40), 11848-51. https://doi.org/10.1002/anie.201505648
Schweitzer-Chaput, Bertrand, et al. "Acid-Mediated Formation of Radicals or Baeyer-Villiger Oxidation from Criegee Adducts." Angewandte Chemie (International ed. in English) vol. 54,40 (2015): 11848-51. doi: https://doi.org/10.1002/anie.201505648
Schweitzer-Chaput B, Kurtén T, Klussmann M. Acid-Mediated Formation of Radicals or Baeyer-Villiger Oxidation from Criegee Adducts. Angew Chem Int Ed Engl. 2015 Sep 28;54(40):11848-51. doi: 10.1002/anie.201505648. Epub 2015 Aug 12. PMID: 26267787.
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Computational Study of Hydrogen Shifts and Ring-Opening Mechanisms in α-Pinene Ozonolysis Products.

The journal of physical chemistry. A

Kurtén T, Rissanen MP, Mackeprang K, Thornton JA, Hyttinen N, Jørgensen S, Ehn M, Kjaergaard HG.
PMID: 26529548
J Phys Chem A. 2015 Nov 19;119(46):11366-75. doi: 10.1021/acs.jpca.5b08948. Epub 2015 Nov 10.

Autoxidation by sequential peroxy radical hydrogen shifts (H-shifts) and O2 additions has recently emerged as a promising mechanism for the rapid formation of highly oxidized, low-volatility organic compounds in the atmosphere. A key prerequisite for autoxidation is that the...

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Kurtén T, Rissanen MP, Mackeprang K, et al. Computational Study of Hydrogen Shifts and Ring-Opening Mechanisms in α-Pinene Ozonolysis Products. J Phys Chem A. 2015;119(46):11366-75doi: 10.1021/acs.jpca.5b08948.
Kurtén, T., Rissanen, M. P., Mackeprang, K., Thornton, J. A., Hyttinen, N., Jørgensen, S., Ehn, M., & Kjaergaard, H. G. (2015). Computational Study of Hydrogen Shifts and Ring-Opening Mechanisms in α-Pinene Ozonolysis Products. The journal of physical chemistry. A, 119(46), 11366-75. https://doi.org/10.1021/acs.jpca.5b08948
Kurtén, Theo, et al. "Computational Study of Hydrogen Shifts and Ring-Opening Mechanisms in α-Pinene Ozonolysis Products." The journal of physical chemistry. A vol. 119,46 (2015): 11366-75. doi: https://doi.org/10.1021/acs.jpca.5b08948
Kurtén T, Rissanen MP, Mackeprang K, Thornton JA, Hyttinen N, Jørgensen S, Ehn M, Kjaergaard HG. Computational Study of Hydrogen Shifts and Ring-Opening Mechanisms in α-Pinene Ozonolysis Products. J Phys Chem A. 2015 Nov 19;119(46):11366-75. doi: 10.1021/acs.jpca.5b08948. Epub 2015 Nov 10. PMID: 26529548.
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Circular dichroism of 1,3-dioxane-type (2'-naphthyl)methylene acetals of glycosides.

Chirality

Kurtán T, Borbás A, Szabó ZB, Lipták A, Bényei A, Antus S.
PMID: 15034907
Chirality. 2004 May 05;16(4):244-50. doi: 10.1002/chir.20019.

The CD spectra are reported for a series of 1,3-dioxane-type 4,6-O-(2'-naphthyl)methylene acetals of carbohydrates with and without interacting aromatic protective groups on the C-1, C-2, and C-3 hydroxy groups. In the absence of interacting chromophores, the signs of the...

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Kurtán T, Borbás A, Szabó ZB, et al. Circular dichroism of 1,3-dioxane-type (2'-naphthyl)methylene acetals of glycosides. Chirality. 2004;16(4):244-50doi: 10.1002/chir.20019.
Kurtán, T., Borbás, A., Szabó, Z. B., Lipták, A., Bényei, A., & Antus, S. (2004). Circular dichroism of 1,3-dioxane-type (2'-naphthyl)methylene acetals of glycosides. Chirality, 16(4), 244-50. https://doi.org/10.1002/chir.20019
Kurtán, Tibor, et al. "Circular dichroism of 1,3-dioxane-type (2'-naphthyl)methylene acetals of glycosides." Chirality vol. 16,4 (2004): 244-50. doi: https://doi.org/10.1002/chir.20019
Kurtán T, Borbás A, Szabó ZB, Lipták A, Bényei A, Antus S. Circular dichroism of 1,3-dioxane-type (2'-naphthyl)methylene acetals of glycosides. Chirality. 2004 May 05;16(4):244-50. doi: 10.1002/chir.20019. PMID: 15034907.
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Ab initio and density functional theory reinvestigation of gas-phase sulfuric acid monohydrate and ammonium hydrogen sulfate.

The journal of physical chemistry. A

Kurtén T, Sundberg MR, Vehkamäki H, Noppel M, Blomqvist J, Kulmala M.
PMID: 16737269
J Phys Chem A. 2006 Jun 08;110(22):7178-88. doi: 10.1021/jp0613081.

We have calculated the thermochemical parameters for the reactions H(2)SO(4) + H(2)O H(2)SO(4).H(2)O and H(2)SO(4) + NH(3) H(2)SO(4).NH(3) using the B3LYP and PW91 functionals, MP2 perturbation theory and four different basis sets. Different methods and basis sets yield very...

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Kurtén T, Sundberg MR, Vehkamäki H, et al. Ab initio and density functional theory reinvestigation of gas-phase sulfuric acid monohydrate and ammonium hydrogen sulfate. J Phys Chem A. 2006;110(22):7178-88doi: 10.1021/jp0613081.
Kurtén, T., Sundberg, M. R., Vehkamäki, H., Noppel, M., Blomqvist, J., & Kulmala, M. (2006). Ab initio and density functional theory reinvestigation of gas-phase sulfuric acid monohydrate and ammonium hydrogen sulfate. The journal of physical chemistry. A, 110(22), 7178-88. https://doi.org/10.1021/jp0613081
Kurtén, Theo, et al. "Ab initio and density functional theory reinvestigation of gas-phase sulfuric acid monohydrate and ammonium hydrogen sulfate." The journal of physical chemistry. A vol. 110,22 (2006): 7178-88. doi: https://doi.org/10.1021/jp0613081
Kurtén T, Sundberg MR, Vehkamäki H, Noppel M, Blomqvist J, Kulmala M. Ab initio and density functional theory reinvestigation of gas-phase sulfuric acid monohydrate and ammonium hydrogen sulfate. J Phys Chem A. 2006 Jun 08;110(22):7178-88. doi: 10.1021/jp0613081. PMID: 16737269.
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Monochromator-interferometer combination for submillimeter astronomical spectrometry from aircraft.

Applied optics

Harwit M, Kurtz NT, Russell RW, Smyers S.
PMID: 20372261
Appl Opt. 1981 Nov 01;20(21):3792-6. doi: 10.1364/AO.20.003792.

A simple interferometer placed in front of a liquid helium cooled grating instrument was constructed; we have attained a spectral resolution of ?0.1 cm(-1) in the wavelength range of ~64 cm(-1) (157 microm) during observations from the NASA Kuiper...

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Harwit M, Kurtz NT, Russell RW, et al. Monochromator-interferometer combination for submillimeter astronomical spectrometry from aircraft. Appl Opt. 1981;20(21):3792-6doi: 10.1364/AO.20.003792.
Harwit, M., Kurtz, N. T., Russell, R. W., & Smyers, S. (1981). Monochromator-interferometer combination for submillimeter astronomical spectrometry from aircraft. Applied optics, 20(21), 3792-6. https://doi.org/10.1364/AO.20.003792
Harwit, M, et al. "Monochromator-interferometer combination for submillimeter astronomical spectrometry from aircraft." Applied optics vol. 20,21 (1981): 3792-6. doi: https://doi.org/10.1364/AO.20.003792
Harwit M, Kurtz NT, Russell RW, Smyers S. Monochromator-interferometer combination for submillimeter astronomical spectrometry from aircraft. Appl Opt. 1981 Nov 01;20(21):3792-6. doi: 10.1364/AO.20.003792. PMID: 20372261.
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Toward a study of culture suitable for (Frontiers in) cultural psychology.

Frontiers in psychology

Kurtiş T, Adams G.
PMID: 23847567
Front Psychol. 2013 Jul 02;4:392. doi: 10.3389/fpsyg.2013.00392. eCollection 2013.

No abstract available.

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Kurtiş T, Adams G. Toward a study of culture suitable for (Frontiers in) cultural psychology. Front Psychol. 2013;4:392doi: 10.3389/fpsyg.2013.00392.
Kurtiş, T., & Adams, G. (2013). Toward a study of culture suitable for (Frontiers in) cultural psychology. Frontiers in psychology, 4392. https://doi.org/10.3389/fpsyg.2013.00392
Kurtiş, Tuğçe, and Adams, Glenn. "Toward a study of culture suitable for (Frontiers in) cultural psychology." Frontiers in psychology vol. 4 (2013): 392. doi: https://doi.org/10.3389/fpsyg.2013.00392
Kurtiş T, Adams G. Toward a study of culture suitable for (Frontiers in) cultural psychology. Front Psychol. 2013 Jul 02;4:392. doi: 10.3389/fpsyg.2013.00392. eCollection 2013. PMID: 23847567; PMCID: PMC3698452.
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The formation of highly oxidized multifunctional products in the ozonolysis of cyclohexene.

Journal of the American Chemical Society

Rissanen MP, Kurtén T, Sipilä M, Thornton JA, Kangasluoma J, Sarnela N, Junninen H, Jørgensen S, Schallhart S, Kajos MK, Taipale R, Springer M, Mentel TF, Ruuskanen T, Petäjä T, Worsnop DR, Kjaergaard HG, Ehn M.
PMID: 25283472
J Am Chem Soc. 2014 Nov 05;136(44):15596-606. doi: 10.1021/ja507146s. Epub 2014 Oct 21.

The prompt formation of highly oxidized organic compounds in the ozonolysis of cyclohexene (C6H10) was investigated by means of laboratory experiments together with quantum chemical calculations. The experiments were performed in borosilicate glass flow tube reactors coupled to a...

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Rissanen MP, Kurtén T, Sipilä M, et al. The formation of highly oxidized multifunctional products in the ozonolysis of cyclohexene. J Am Chem Soc. 2014;136(44):15596-606doi: 10.1021/ja507146s.
Rissanen, M. P., Kurtén, T., Sipilä, M., Thornton, J. A., Kangasluoma, J., Sarnela, N., Junninen, H., Jørgensen, S., Schallhart, S., Kajos, M. K., Taipale, R., Springer, M., Mentel, T. F., Ruuskanen, T., Petäjä, T., Worsnop, D. R., Kjaergaard, H. G., & Ehn, M. (2014). The formation of highly oxidized multifunctional products in the ozonolysis of cyclohexene. Journal of the American Chemical Society, 136(44), 15596-606. https://doi.org/10.1021/ja507146s
Rissanen, Matti P, et al. "The formation of highly oxidized multifunctional products in the ozonolysis of cyclohexene." Journal of the American Chemical Society vol. 136,44 (2014): 15596-606. doi: https://doi.org/10.1021/ja507146s
Rissanen MP, Kurtén T, Sipilä M, Thornton JA, Kangasluoma J, Sarnela N, Junninen H, Jørgensen S, Schallhart S, Kajos MK, Taipale R, Springer M, Mentel TF, Ruuskanen T, Petäjä T, Worsnop DR, Kjaergaard HG, Ehn M. The formation of highly oxidized multifunctional products in the ozonolysis of cyclohexene. J Am Chem Soc. 2014 Nov 05;136(44):15596-606. doi: 10.1021/ja507146s. Epub 2014 Oct 21. PMID: 25283472.
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Detection of compressible and incompressible states in quantum dots and antidots by far-infrared spectroscopy.

Physical review letters

Bollweg K, Eberl K, Grambow P, Gudmundsson V, Heitmann D, Kurth T, Vasiliadou E.
PMID: 10060785
Phys Rev Lett. 1996 Apr 08;76(15):2774-2777. doi: 10.1103/PhysRevLett.76.2774.

No abstract available.

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Bollweg K, Eberl K, Grambow P, et al. Detection of compressible and incompressible states in quantum dots and antidots by far-infrared spectroscopy. Phys Rev Lett. 1996;76(15):2774-2777doi: 10.1103/PhysRevLett.76.2774.
Bollweg, K., Eberl, K., Grambow, P., Gudmundsson, V., Heitmann, D., Kurth, T., & Vasiliadou, E. (1996). Detection of compressible and incompressible states in quantum dots and antidots by far-infrared spectroscopy. Physical review letters, 76(15), 2774-2777. https://doi.org/10.1103/PhysRevLett.76.2774
Bollweg, et al. "Detection of compressible and incompressible states in quantum dots and antidots by far-infrared spectroscopy." Physical review letters vol. 76,15 (1996): 2774-2777. doi: https://doi.org/10.1103/PhysRevLett.76.2774
Bollweg K, Eberl K, Grambow P, Gudmundsson V, Heitmann D, Kurth T, Vasiliadou E. Detection of compressible and incompressible states in quantum dots and antidots by far-infrared spectroscopy. Phys Rev Lett. 1996 Apr 08;76(15):2774-2777. doi: 10.1103/PhysRevLett.76.2774. PMID: 10060785.
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