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Differential Solvation.

Chemistry (Weinheim an der Bergstrasse, Germany)

Schreckenbach G.
PMID: 27727522
Chemistry. 2017 Mar 17;23(16):3797-3803. doi: 10.1002/chem.201604075. Epub 2016 Dec 05.

Solvation effects influence reaction equilibria by preferentially stabilizing reactants or products (differential solvation). We propose using simple electrostatic concepts to qualitatively interpret and understand these effects, applying the Born and Kirkwood-Onsager equations. Scenarios include, for charged species, redox potentials,...

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Schreckenbach G. Differential Solvation. Chemistry. 2016;23(16):3797-3803doi: 10.1002/chem.201604075.
Schreckenbach, G. (2017). Differential Solvation. Chemistry (Weinheim an der Bergstrasse, Germany), 23(16), 3797-3803. https://doi.org/10.1002/chem.201604075
Schreckenbach, Georg. "Differential Solvation." Chemistry (Weinheim an der Bergstrasse, Germany) vol. 23,16 (2017): 3797-3803. doi: https://doi.org/10.1002/chem.201604075
Schreckenbach G. Differential Solvation. Chemistry. 2017 Mar 17;23(16):3797-3803. doi: 10.1002/chem.201604075. Epub 2016 Dec 05. PMID: 27727522.
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Characterization of anodic spark-converted titanium surfaces for biomedical applications.

Journal of materials science. Materials in medicine

Schreckenbach JP, Marx G, Schlottig F, Textor M, Spencer ND.
PMID: 15348111
J Mater Sci Mater Med. 1999 Aug;10(8):453-7. doi: 10.1023/a:1008988706980.

The aim of the present study was to characterize the surface morphology, microstructure and the chemical composition of anodic spark-converted titanium surfaces. The coatings were prepared in an electrochemical cell by the anodic spark deposition technique in an aqueous...

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Schreckenbach JP, Marx G, Schlottig F, et al. Characterization of anodic spark-converted titanium surfaces for biomedical applications. J Mater Sci Mater Med. 1999;10(8):453-7doi: 10.1023/a:1008988706980.
Schreckenbach, J. P., Marx, G., Schlottig, F., Textor, M., & Spencer, N. D. (1999). Characterization of anodic spark-converted titanium surfaces for biomedical applications. Journal of materials science. Materials in medicine, 10(8), 453-7. https://doi.org/10.1023/a:1008988706980
Schreckenbach, J P, et al. "Characterization of anodic spark-converted titanium surfaces for biomedical applications." Journal of materials science. Materials in medicine vol. 10,8 (1999): 453-7. doi: https://doi.org/10.1023/a:1008988706980
Schreckenbach JP, Marx G, Schlottig F, Textor M, Spencer ND. Characterization of anodic spark-converted titanium surfaces for biomedical applications. J Mater Sci Mater Med. 1999 Aug;10(8):453-7. doi: 10.1023/a:1008988706980. PMID: 15348111.
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Performance of relativistic effective core potentials in DFT calculations on actinide compounds.

The journal of physical chemistry. A

Odoh SO, Schreckenbach G.
PMID: 20039716
J Phys Chem A. 2010 Feb 04;114(4):1957-63. doi: 10.1021/jp909576w.

Density functional theory (DFT) calculations using relativistic effective core potentials (RECPs) have emerged as a robust and fast method of calculating the structural parameters and energy changes of the thermochemical reactions of actinide complexes. A comparative investigation of the...

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Odoh SO, Schreckenbach G. Performance of relativistic effective core potentials in DFT calculations on actinide compounds. J Phys Chem A. 2010;114(4):1957-63doi: 10.1021/jp909576w.
Odoh, S. O., & Schreckenbach, G. (2010). Performance of relativistic effective core potentials in DFT calculations on actinide compounds. The journal of physical chemistry. A, 114(4), 1957-63. https://doi.org/10.1021/jp909576w
Odoh, Samuel O, and Schreckenbach, Georg. "Performance of relativistic effective core potentials in DFT calculations on actinide compounds." The journal of physical chemistry. A vol. 114,4 (2010): 1957-63. doi: https://doi.org/10.1021/jp909576w
Odoh SO, Schreckenbach G. Performance of relativistic effective core potentials in DFT calculations on actinide compounds. J Phys Chem A. 2010 Feb 04;114(4):1957-63. doi: 10.1021/jp909576w. PMID: 20039716.
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Chalcogenophilicity of mercury.

Inorganic chemistry

Asaduzzaman AM, Schreckenbach G.
PMID: 21405027
Inorg Chem. 2011 Apr 18;50(8):3791-8. doi: 10.1021/ic200199b. Epub 2011 Mar 15.

Density-functional theory (DFT) calculations have been carried out to investigate the chalcogenophilicity of mercury (Hg) reported recently [J. Am. Chem. Soc. 2010, 132, 647-655]. Molecules of different sizes have been studied including ME, [M(EH)(4)](n), M(SH)(3)EH (M = Cd, Hg;...

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Asaduzzaman AM, Schreckenbach G. Chalcogenophilicity of mercury. Inorg Chem. 2011;50(8):3791-8doi: 10.1021/ic200199b.
Asaduzzaman, A. M., & Schreckenbach, G. (2011). Chalcogenophilicity of mercury. Inorganic chemistry, 50(8), 3791-8. https://doi.org/10.1021/ic200199b
Asaduzzaman, Abu Md, and Schreckenbach, Georg. "Chalcogenophilicity of mercury." Inorganic chemistry vol. 50,8 (2011): 3791-8. doi: https://doi.org/10.1021/ic200199b
Asaduzzaman AM, Schreckenbach G. Chalcogenophilicity of mercury. Inorg Chem. 2011 Apr 18;50(8):3791-8. doi: 10.1021/ic200199b. Epub 2011 Mar 15. PMID: 21405027.
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A comparative relativistic DFT and ab initio study on the structure and thermodynamics of the oxofluorides of uranium(IV), (V) and (VI).

Chemistry (Weinheim an der Bergstrasse, Germany)

Shamov GA, Schreckenbach G, Vo TN.
PMID: 17373000
Chemistry. 2007;13(17):4932-47. doi: 10.1002/chem.200601244.

All the possible uranium(VI, V, IV) oxides, fluorides and oxofluorides were studied theoretically by using density functional theory (DFT) in the generalised gradient approximation (GGA), and three different relativistic methods (all-electron scalar four component Dyall RESC method (AE), relativistic...

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Shamov GA, Schreckenbach G, Vo TN. A comparative relativistic DFT and ab initio study on the structure and thermodynamics of the oxofluorides of uranium(IV), (V) and (VI). Chemistry. 2007;13(17):4932-47doi: 10.1002/chem.200601244.
Shamov, G. A., Schreckenbach, G., & Vo, T. N. (2007). A comparative relativistic DFT and ab initio study on the structure and thermodynamics of the oxofluorides of uranium(IV), (V) and (VI). Chemistry (Weinheim an der Bergstrasse, Germany), 13(17), 4932-47. https://doi.org/10.1002/chem.200601244
Shamov, Grigory A, et al. "A comparative relativistic DFT and ab initio study on the structure and thermodynamics of the oxofluorides of uranium(IV), (V) and (VI)." Chemistry (Weinheim an der Bergstrasse, Germany) vol. 13,17 (2007): 4932-47. doi: https://doi.org/10.1002/chem.200601244
Shamov GA, Schreckenbach G, Vo TN. A comparative relativistic DFT and ab initio study on the structure and thermodynamics of the oxofluorides of uranium(IV), (V) and (VI). Chemistry. 2007;13(17):4932-47. doi: 10.1002/chem.200601244. PMID: 17373000.
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Theoretical exploration of uranyl complexes of a designed polypyrrolic macrocycle: structure/property effects of hinge size on Pacman-shaped complexes.

Dalton transactions (Cambridge, England : 2003)

Pan QJ, Odoh SO, Schreckenbach G, Arnold PL, Love JB.
PMID: 22714056
Dalton Trans. 2012 Aug 07;41(29):8878-85. doi: 10.1039/c2dt31055d. Epub 2012 Jun 20.

A polypyrrolic macrocycle with naphthalenyl linkers between the N(4)-donor compartments (L(2)) was designed theoretically according to its experimentally-known analogues with phenylenyl (L(1)) and anthracenyl (L(3)) linkers. The uranyl and bis(uranyl) complexes formed by this L(2) ligand have been examined...

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Pan QJ, Odoh SO, Schreckenbach G, et al. Theoretical exploration of uranyl complexes of a designed polypyrrolic macrocycle: structure/property effects of hinge size on Pacman-shaped complexes. Dalton Trans. 2012;41(29):8878-85doi: 10.1039/c2dt31055d.
Pan, Q. J., Odoh, S. O., Schreckenbach, G., Arnold, P. L., & Love, J. B. (2012). Theoretical exploration of uranyl complexes of a designed polypyrrolic macrocycle: structure/property effects of hinge size on Pacman-shaped complexes. Dalton transactions (Cambridge, England : 2003), 41(29), 8878-85. https://doi.org/10.1039/c2dt31055d
Pan, Qing-Jiang, et al. "Theoretical exploration of uranyl complexes of a designed polypyrrolic macrocycle: structure/property effects of hinge size on Pacman-shaped complexes." Dalton transactions (Cambridge, England : 2003) vol. 41,29 (2012): 8878-85. doi: https://doi.org/10.1039/c2dt31055d
Pan QJ, Odoh SO, Schreckenbach G, Arnold PL, Love JB. Theoretical exploration of uranyl complexes of a designed polypyrrolic macrocycle: structure/property effects of hinge size on Pacman-shaped complexes. Dalton Trans. 2012 Aug 07;41(29):8878-85. doi: 10.1039/c2dt31055d. Epub 2012 Jun 20. PMID: 22714056.
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Identification of higher representations of the U(6/4) supersymmetry in the nucleus 195Ir.

Physical review letters

Borner HG, Cizewski JA, Colvin GG, Hoyler F, Kerr SA, Schreckenback K.
PMID: 10034277
Phys Rev Lett. 1987 Jan 05;58(1):10-12. doi: 10.1103/PhysRevLett.58.10.

No abstract available.

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Borner HG, Cizewski JA, Colvin GG, et al. Identification of higher representations of the U(6/4) supersymmetry in the nucleus 195Ir. Phys Rev Lett. 1987;58(1):10-12doi: 10.1103/PhysRevLett.58.10.
Borner, H. G., Cizewski, J. A., Colvin, G. G., Hoyler, F., Kerr, S. A., & Schreckenback, K. (1987). Identification of higher representations of the U(6/4) supersymmetry in the nucleus 195Ir. Physical review letters, 58(1), 10-12. https://doi.org/10.1103/PhysRevLett.58.10
Borner, et al. "Identification of higher representations of the U(6/4) supersymmetry in the nucleus 195Ir." Physical review letters vol. 58,1 (1987): 10-12. doi: https://doi.org/10.1103/PhysRevLett.58.10
Borner HG, Cizewski JA, Colvin GG, Hoyler F, Kerr SA, Schreckenback K. Identification of higher representations of the U(6/4) supersymmetry in the nucleus 195Ir. Phys Rev Lett. 1987 Jan 05;58(1):10-12. doi: 10.1103/PhysRevLett.58.10. PMID: 10034277.
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High-sensitivity measurements of the excitation function for Bhabha scattering at MeV energies.

Physical review. D, Particles and fields

Armbruster P, Kienle P, Kozhuharov C, Krusche B, Schreckenbach K, Tsertos H.
PMID: 10011958
Phys Rev D Part Fields. 1989 Sep 01;40(5):1397-1410. doi: 10.1103/physrevd.40.1397.

No abstract available.

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Armbruster P, Kienle P, Kozhuharov C, et al. High-sensitivity measurements of the excitation function for Bhabha scattering at MeV energies. Phys Rev D Part Fields. 1989;40(5):1397-1410doi: 10.1103/physrevd.40.1397.
Armbruster, P., Kienle, P., Kozhuharov, C., Krusche, B., Schreckenbach, K., & Tsertos, H. (1989). High-sensitivity measurements of the excitation function for Bhabha scattering at MeV energies. Physical review. D, Particles and fields, 40(5), 1397-1410. https://doi.org/10.1103/physrevd.40.1397
Armbruster, et al. "High-sensitivity measurements of the excitation function for Bhabha scattering at MeV energies." Physical review. D, Particles and fields vol. 40,5 (1989): 1397-1410. doi: https://doi.org/10.1103/physrevd.40.1397
Armbruster P, Kienle P, Kozhuharov C, Krusche B, Schreckenbach K, Tsertos H. High-sensitivity measurements of the excitation function for Bhabha scattering at MeV energies. Phys Rev D Part Fields. 1989 Sep 01;40(5):1397-1410. doi: 10.1103/physrevd.40.1397. PMID: 10011958.
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Adsorption of Actinide (U-Pu) Complexes on the Silicene and Germanene Surface: A Theoretical Study.

The journal of physical chemistry. A

Grover P, Ferch LS, Schreckenbach G.
PMID: 32013429
J Phys Chem A. 2020 Feb 27;124(8):1522-1534. doi: 10.1021/acs.jpca.9b10888. Epub 2020 Feb 17.

Adsorption of actinide (Ac = U, Np, Pu) complexes with environmentally relevant ligands on silicene and germanene surfaces has been investigated using density functional theory to determine the geometrical, energetic, and electronic properties. Three types of ligands for each...

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Grover P, Ferch LS, Schreckenbach G. Adsorption of Actinide (U-Pu) Complexes on the Silicene and Germanene Surface: A Theoretical Study. J Phys Chem A. 2020;124(8):1522-1534doi: 10.1021/acs.jpca.9b10888.
Grover, P., Ferch, L. S., & Schreckenbach, G. (2020). Adsorption of Actinide (U-Pu) Complexes on the Silicene and Germanene Surface: A Theoretical Study. The journal of physical chemistry. A, 124(8), 1522-1534. https://doi.org/10.1021/acs.jpca.9b10888
Grover, Payal, et al. "Adsorption of Actinide (U-Pu) Complexes on the Silicene and Germanene Surface: A Theoretical Study." The journal of physical chemistry. A vol. 124,8 (2020): 1522-1534. doi: https://doi.org/10.1021/acs.jpca.9b10888
Grover P, Ferch LS, Schreckenbach G. Adsorption of Actinide (U-Pu) Complexes on the Silicene and Germanene Surface: A Theoretical Study. J Phys Chem A. 2020 Feb 27;124(8):1522-1534. doi: 10.1021/acs.jpca.9b10888. Epub 2020 Feb 17. PMID: 32013429.
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Could new U(ii) complexes be accessible via tuning hybrid heterocalix[4]arene? A theoretical study of redox and structural properties.

Dalton transactions (Cambridge, England : 2003)

Zhao HB, Zheng M, Schreckenbach G, Pan QJ.
PMID: 29372914
Dalton Trans. 2018 Feb 13;47(7):2148-2151. doi: 10.1039/c7dt04557c.

Tuning the building blocks of pyrrole and arene/pyridine in hybrid heterocalix[4]arene allows for the possible accessibility of several intriguing divalent uranium complexes, which are energetically stabilized by enhanced δ(U-Ar) bonds and further corroborated by computed U

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Zhao HB, Zheng M, Schreckenbach G, et al. Could new U(ii) complexes be accessible via tuning hybrid heterocalix[4]arene? A theoretical study of redox and structural properties. Dalton Trans. 2018;47(7):2148-2151doi: 10.1039/c7dt04557c.
Zhao, H. B., Zheng, M., Schreckenbach, G., & Pan, Q. J. (2018). Could new U(ii) complexes be accessible via tuning hybrid heterocalix[4]arene? A theoretical study of redox and structural properties. Dalton transactions (Cambridge, England : 2003), 47(7), 2148-2151. https://doi.org/10.1039/c7dt04557c
Zhao, Hong-Bo, et al. "Could new U(ii) complexes be accessible via tuning hybrid heterocalix[4]arene? A theoretical study of redox and structural properties." Dalton transactions (Cambridge, England : 2003) vol. 47,7 (2018): 2148-2151. doi: https://doi.org/10.1039/c7dt04557c
Zhao HB, Zheng M, Schreckenbach G, Pan QJ. Could new U(ii) complexes be accessible via tuning hybrid heterocalix[4]arene? A theoretical study of redox and structural properties. Dalton Trans. 2018 Feb 13;47(7):2148-2151. doi: 10.1039/c7dt04557c. PMID: 29372914.
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Nuclear structure of 238Np from neutron-capture and alpha -decay measurements.

Physical review. C, Nuclear physics

Barreau G, Börner HG, Casten RF, Drissi S, Dupzyk RJ, Hoff RW, Kane WR, Kern J, Landrum JH, Mann LG, Ruhter WD, Schreckenbach K, Strassmann W, Warner DD, White DH.
PMID: 9966383
Phys Rev C Nucl Phys. 1990 Feb;41(2):484-512. doi: 10.1103/physrevc.41.484.

No abstract available.

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Barreau G, Börner HG, Casten RF, et al. Nuclear structure of 238Np from neutron-capture and alpha -decay measurements. Phys Rev C Nucl Phys. 1990;41(2):484-512doi: 10.1103/physrevc.41.484.
Barreau, G., Börner, H. G., Casten, R. F., Drissi, S., Dupzyk, R. J., Hoff, R. W., Kane, W. R., Kern, J., Landrum, J. H., Mann, L. G., Ruhter, W. D., Schreckenbach, K., Strassmann, W., Warner, D. D., & White, D. H. (1990). Nuclear structure of 238Np from neutron-capture and alpha -decay measurements. Physical review. C, Nuclear physics, 41(2), 484-512. https://doi.org/10.1103/physrevc.41.484
Barreau, et al. "Nuclear structure of 238Np from neutron-capture and alpha -decay measurements." Physical review. C, Nuclear physics vol. 41,2 (1990): 484-512. doi: https://doi.org/10.1103/physrevc.41.484
Barreau G, Börner HG, Casten RF, Drissi S, Dupzyk RJ, Hoff RW, Kane WR, Kern J, Landrum JH, Mann LG, Ruhter WD, Schreckenbach K, Strassmann W, Warner DD, White DH. Nuclear structure of 238Np from neutron-capture and alpha -decay measurements. Phys Rev C Nucl Phys. 1990 Feb;41(2):484-512. doi: 10.1103/physrevc.41.484. PMID: 9966383.
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Nuclear structure of 170Tm from neutron-capture and (d,p)-reaction measurements.

Physical review. C, Nuclear physics

Balodis M, Bersillon O, Börner HG, Casten RF, Colvin GG, Georgii R, Gill RL, Graw G, Hofer D, Hoff RW, Hoyler F, Joly S, Kern J, Khitrov VA, Ott J, Prokofjevs P, Schauer W, Schreckenbach K, Schründer S, Simonova L, Sukhovoj AM, Valnion B, von Egidy T.
PMID: 9971324
Phys Rev C Nucl Phys. 1996 Jul;54(1):78-116. doi: 10.1103/physrevc.54.78.

No abstract available.

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Balodis M, Bersillon O, Börner HG, et al. Nuclear structure of 170Tm from neutron-capture and (d,p)-reaction measurements. Phys Rev C Nucl Phys. 1996;54(1):78-116doi: 10.1103/physrevc.54.78.
Balodis, M., Bersillon, O., Börner, H. G., Casten, R. F., Colvin, G. G., Georgii, R., Gill, R. L., Graw, G., Hofer, D., Hoff, R. W., Hoyler, F., Joly, S., Kern, J., Khitrov, V. A., Ott, J., Prokofjevs, P., Schauer, W., Schreckenbach, K., Schründer, S., Simonova, L., Sukhovoj, A. M., Valnion, B., & von Egidy T. (1996). Nuclear structure of 170Tm from neutron-capture and (d,p)-reaction measurements. Physical review. C, Nuclear physics, 54(1), 78-116. https://doi.org/10.1103/physrevc.54.78
Balodis, et al. "Nuclear structure of 170Tm from neutron-capture and (d,p)-reaction measurements." Physical review. C, Nuclear physics vol. 54,1 (1996): 78-116. doi: https://doi.org/10.1103/physrevc.54.78
Balodis M, Bersillon O, Börner HG, Casten RF, Colvin GG, Georgii R, Gill RL, Graw G, Hofer D, Hoff RW, Hoyler F, Joly S, Kern J, Khitrov VA, Ott J, Prokofjevs P, Schauer W, Schreckenbach K, Schründer S, Simonova L, Sukhovoj AM, Valnion B, von Egidy T. Nuclear structure of 170Tm from neutron-capture and (d,p)-reaction measurements. Phys Rev C Nucl Phys. 1996 Jul;54(1):78-116. doi: 10.1103/physrevc.54.78. PMID: 9971324.
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Showing 1 to 12 of 100 entries