The Molpro quantum chemistry package
Werner, Hans-Joachim, Knowles, Peter J, Manby, Frederick R, Black, Joshua A, Doll, Klaus, Heßelmann, Andreas, Kats, Daniel, Köhn, Andreas, Korona, Tatiana, Kreplin, David A, Ma, Qianli, Miller, 3rd, Thomas F, Mitrushchenkov, Alexander, Peterson, Kirk A, Polyak, Iakov, Rauhut, Guntram, Sibaev, Marat
Published in The Journal of chemical physics (14.04.2020)
Published in The Journal of chemical physics (14.04.2020)
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Journal Article
Electronic and transport properties of LiCoO2
Andriyevsky, Bohdan, Doll, Klaus, Jacob, Timo
Published in Physical chemistry chemical physics : PCCP (14.11.2014)
Published in Physical chemistry chemical physics : PCCP (14.11.2014)
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Journal Article
Interferon-gamma producing CD4 + T cells quantified by flow cytometry as early markers for Mycobacterium avium ssp. paratuberculosis infection in cattle
Bulun, Hakan, Bridger, Philip S, Schillinger, Simone, Akineden, Ömer, Barth, Stefanie A, Fischer, Marta, Henrich, Manfred, Seeger, Torsten, Doll, Klaus, Bülte, Michael, Bauerfeind, Rolf, Menge, Christian
Published in Veterinary research (Paris) (31.05.2024)
Published in Veterinary research (Paris) (31.05.2024)
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Journal Article
New aspects in the pathogenesis of abomasal displacement
Doll, Klaus, Sickinger, Marlene, Seeger, Torsten
Published in The veterinary journal (1997) (01.08.2009)
Published in The veterinary journal (1997) (01.08.2009)
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Journal Article
Black Current: Structure, Characterization, and Optoelectronic Properties of Ce3Cl3[MoO6]
Dorn, Katharina V., Blaschkowski, Björn, Bamberger, Heiko, van Slageren, Joris, Doll, Klaus, Claus, Ralf, Matsumoto, Yosuke, Takagi, Hidenori, Hartenbach, Ingo
Published in Chemistry : a European journal (12.06.2019)
Published in Chemistry : a European journal (12.06.2019)
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Journal Article
Vaccine-induced antibodies linked to bovine neonatal pancytopenia (BNP) recognize cattle major histocompatibility complex class I (MHC I)
Deutskens, Fabian, Lamp, Benjamin, Riedel, Christiane M, Wentz, Eveline, Lochnit, Günter, Doll, Klaus, Thiel, Heinz-Jürgen, Rümenapf, Till
Published in Veterinary research (Paris) (30.08.2011)
Published in Veterinary research (Paris) (30.08.2011)
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Journal Article
Extreme pressure conditions of bas based materials: Detailed study of structural changes, band gap engineering, elastic constants and mechanical properties
Zagorac, Dejan, Zagorac, Jelena, Doll, Klaus, Cebela, Maria, Matovic, Branko
Published in Processing and Application of Ceramics (01.01.2019)
Published in Processing and Application of Ceramics (01.01.2019)
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Journal Article
The structural, electronic and vibrational properties of LiOH and NaOH: an ab initio study
Mérawa, Mohammadou, Labeguerie, Pierre, Ugliengo, Piero, Doll, Klaus, Dovesi, Roberto
Published in Chemical physics letters (01.04.2004)
Published in Chemical physics letters (01.04.2004)
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Journal Article
Insulin resistance and abomasal motility disorders in cows detected by use of abomasoduodenal electromyography after surgical correction of left displaced abomasum
Pravettoni, Davide, Doll, Klaus, Hummel, Markus, Cavallone, Elena, Re, Michela, Belloli, Angelo G
Published in American journal of veterinary research (01.10.2004)
Published in American journal of veterinary research (01.10.2004)
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Journal Article
On the role of the exact Hartree–Fock exchange in determining the Jahn–Teller energy splitting and electronic band gap in the KBF3 (B=Sc, Ti, Fe, Co, Cr and Cu) perovskites. A quantum mechanical investigation
Pascale, Fabien, Pastore, Mariachiara, Doll, Klaus, Dovesi, Roberto
Published in Chemical physics letters (01.02.2024)
Published in Chemical physics letters (01.02.2024)
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Journal Article
The role of spin density for understanding the superexchange mechanism in transition metal ionic compounds. The case of KMF 3 (M = Mn, Fe, Co, Ni, Cu) perovskites
Pascale, Fabien, Doll, Klaus, Platonenko, Alexander, Rérat, Michel, Dovesi, Roberto
Published in Physical chemistry chemical physics : PCCP (01.06.2022)
Published in Physical chemistry chemical physics : PCCP (01.06.2022)
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Journal Article
The role of spin density for understanding the superexchange mechanism in transition metal ionic compounds. The case of KMF3 (M = Mn, Fe, Co, Ni, Cu) perovskites
Pascale, Fabien, Doll, Klaus, Platonenko, Alexander, Rérat, Michel, Dovesi, Roberto
Published in Physical chemistry chemical physics : PCCP (01.06.2022)
Published in Physical chemistry chemical physics : PCCP (01.06.2022)
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Journal Article
The role of spin density for understanding the superexchange mechanism in transition metal ionic compounds. The case of KMF (M = Mn, Fe, Co, Ni, Cu) perovskites
Pascale, Fabien, Doll, Klaus, Platonenko, Alexander, Rérat, Michel, Dovesi, Roberto
Published in Physical chemistry chemical physics : PCCP (01.06.2022)
Published in Physical chemistry chemical physics : PCCP (01.06.2022)
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Journal Article
DFT studies on structural stability, vibrational and linear and nonlinear optical properties of low-dimensional zinc sulfide: from the 3D bulk to the 2D monolayer and the 1D zigzag single-walled nanotubes
Masri, Rimel, Larbi, Tarek, Nehdi, Kamel, Doll, Klaus, Amlouk, Mosbah
Published in Physica scripta (01.12.2023)
Published in Physica scripta (01.12.2023)
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Journal Article