• Kemistintie 1, 02150 Espoo

20052020

Research output per year

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Research Output

  • 158 Article
  • 2 Conference contribution
  • 1 Meeting Abstract
2020

A brief visit to the BeCl2/ZnCl2 system and the prediction of a new polymorph of ZnCl2

Deubner, H. L., Bandemehr, J., Karttunen, A. J. & Kraus, F., 25 Jun 2020, In : Zeitschrift fur Naturforschung - Section B Journal of Chemical Sciences.

Research output: Contribution to journalArticleScientificpeer-review

Atomic/molecular layer deposition and electrochemical performance of dilithium 2-aminoterephthalate

Heiska, J., Nisula, M., Rautama, E-L., Karttunen, A. J. & Karppinen, M., 7 Feb 2020, In : Dalton Transactions. 49, 5, p. 1591-1599 9 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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1 Citation (Scopus)
2 Downloads (Pure)

Compressive Properties of Micro-spherical SiO2 Particles

Hellsten, N., Karttunen, A., Engblom, C., Reznichenko, A. & Rantala, E., 2020, Advances in Powder and Ceramic Materials Science. p. 57-66 (The Minerals, Metals & Materials Series).

Research output: Chapter in Book/Report/Conference proceedingConference contributionScientificpeer-review

Electronic band structures of pristine and chemically modified cellulose allomorphs

Srivastava, D., Kuklin, M. S., Ahopelto, J. & Karttunen, A. J., 1 Sep 2020, In : Carbohydrate Polymers. 243, 116440.

Research output: Contribution to journalArticleScientificpeer-review

Evolutionary Algorithm-based Crystal Structure Prediction for Gold(I) Fluoride

Eklund, K., Kuklin, M. S., Kraus, F. & Karttunen, A. J., 1 Jan 2020, (Accepted/In press) In : ChemPhysChem.

Research output: Contribution to journalArticleScientificpeer-review

Rb2[U(NH2)6], a Rubidium Hexaamidouranate(IV) obtained from the Reaction of UI3 with RbNH2 in Anhydrous Ammonia

Rudel, S. S., Karttunen, A. J. & Kraus, F., Apr 2020, In : Zeitschrift fur Anorganische und Allgemeine Chemie.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
Open Access

Speciation of Be2+in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters

Müller, M., Karttunen, A. J. & Buchner, M. R., 7 Jun 2020, In : Chemical Science. 11, 21, p. 5415-5422 8 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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2 Downloads (Pure)

Synthesis and Characterization of A[W2O2F9] (A = Li – Cs)

Stene, R. E., Scheibe, B., Karttunen, A. J., Petry, W. & Kraus, F., 1 May 2020, In : European Journal of Inorganic Chemistry. 11 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
1 Citation (Scopus)

Synthesis and Characterization of the Tetrafluoridochlorates(III) A[ClF4] (A = K, Rb, Cs)

Scheibe, B., Ivlev, S. I., Karttunen, A. J. & Kraus, F., 16 Apr 2020, In : European Journal of Inorganic Chemistry. 2020, 14, p. 1319-1324 6 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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3 Citations (Scopus)
8 Downloads (Pure)

The Crystal Structure of MnF3 Revisited

Bandemehr, J., Stoll, C., Heymann, G., Ivlev, S. I., Karttunen, A. J., Conrad, M., Huppertz, H. & Kraus, F., 22 Apr 2020, In : Zeitschrift fur Anorganische und Allgemeine Chemie. 8 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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12 Downloads (Pure)
2019

A Facile Molecular Machine: Optically Triggered Counterion Migration by Charge Transfer of Linear Donor-π-Acceptor Phosphonium Fluorophores

Belyaev, A., Cheng, Y. H., Liu, Z. Y., Karttunen, A. J., Chou, P. T. & Koshevoy, I. O., 1 Jan 2019, In : Angewandte Chemie - International Edition.

Research output: Contribution to journalArticleScientificpeer-review

4 Citations (Scopus)

Alkuainetaulukon 150-vuotisjuhlavuosi vuonna 2019

Karttunen, A., 24 Apr 2019, In : Dimensio.

Research output: Contribution to journalArticleProfessional

Open Access

An Unprecedented Fully H-Substituted Phosphate Hydride Sr5(PO4)3H Expanding the Apatite Family

Mutschke, A., Wylezich, T., Ritter, C., Karttunen, A. J. & Kunkel, N., 1 Jan 2019, (Accepted/In press) In : European Journal of Inorganic Chemistry.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
1 Citation (Scopus)

A Revised Structure Model for the UCl 6 Structure Type, Novel Modifications of UCl 6 and UBr 5 , and a Comment on the Modifications of Protactinium Pentabromides

Deubner, H. L., Rudel, S. S., Sachs, M., Pietzonka, C., Karttunen, A. J., Ivlev, S. I., Müller, M., Conrad, M., Müller, U. & Kraus, F., 2 May 2019, In : Chemistry - A European Journal. 25, 25, p. 6402-6411 10 p.

Research output: Contribution to journalArticleScientificpeer-review

1 Citation (Scopus)

Binary Lead Fluoride Pb3F8

Deubner, H. L., Sachs, M., Bandemehr, J., Ivlev, S. I., Karttunen, A. J., Kachel, S. R., Klein, B. P., Ruppenthal, L., Schöniger, M., Krug, C. K., Herritsch, J., Gottfried, J. M., Aman, J. N. M., Schmedt auf der Günne, J. & Kraus, F., 2019, In : Chemistry - A European Journal.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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1 Citation (Scopus)
45 Downloads (Pure)

Crystal Structures of α- And β-Nitrogen Trifluoride

Ivlev, S. I., Conrad, M., Hoelzel, M., Karttunen, A. J. & Kraus, F., 6 May 2019, In : Inorganic Chemistry. 58, 9, p. 6422-6430 9 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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9 Downloads (Pure)

Evolutionary Algorithm-Based Crystal Structure Prediction for Copper (I) Fluoride

Kuklin, M., Maschio, L., Usvyat, D., Kraus, F. & Karttunen, A., 2 Sep 2019, In : Chemistry - A European Journal. 25, 49, p. 111528-111537

Research output: Contribution to journalArticleScientificpeer-review

1 Citation (Scopus)

F-bridged Anions of Bromine and Gold: Predictions of Unexpected Behavior

Linnera, J., Ivlev, S. I., Kraus, F. & Karttunen, A. J., 15 Feb 2019, In : Zeitschrift fur Anorganische und Allgemeine Chemie. 645, 3, p. 284-291 8 p.

Research output: Contribution to journalArticleScientificpeer-review

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3 Citations (Scopus)
3 Downloads (Pure)

Half-metallicity in uranium intermetallics: Crystal structure prediction of a high-pressure phase of UCo

Sachs, M., Karttunen, A. J. & Kraus, F., 16 Jan 2019, In : Journal of Physics Condensed Matter. 31, 2, 17 p., 025501.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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1 Citation (Scopus)
29 Downloads (Pure)

Lattice dynamical properties of antiferromagnetic MnO, CoO, and NiO, and the lattice thermal conductivity of NiO

Linnera, J. & Karttunen, A. J., 21 Oct 2019, In : Physical Review B. 100, 14, 9 p., 144307.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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36 Downloads (Pure)

Lattice thermal conductivity of TiS2, ZrS2, and HfS2: Periodic trends studied by dispersion-corrected hybrid density functional methods

Glebko, N. & Karttunen, A. J., 1 Jul 2019, In : Physical Review B. 100, 2, 9 p., 024301.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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1 Citation (Scopus)
75 Downloads (Pure)

Lewis Acidic Behavior of MoOF4 towards the Alkali Metal Fluorides in Anhydrous Hydrogen Fluoride Solutions

Stene, R. E., Scheibe, B., Karttunen, A. J., Petry, W. & Kraus, F., 1 Jan 2019, In : European Journal of Inorganic Chemistry. 32, p. 3672-3682

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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5 Citations (Scopus)
19 Downloads (Pure)

Negative thermal expansion of Cu2O studied by quasi-harmonic approximation and cubic force-constant method

Linnera, J., Erba, A. & Karttunen, A. J., 14 Nov 2019, In : Journal of Chemical Physics. 151, 18, 184109.

Research output: Contribution to journalArticleScientificpeer-review

PbF[Br2F7], a Fluoridobromate(III) of a p-Block Metal

Bandemehr, J., Sachs, M., Ivlev, S. I., Karttunen, A. J. & Kraus, F., 1 Jan 2019, (Accepted/In press) In : European Journal of Inorganic Chemistry. 2020, 1, p. 64-70

Research output: Contribution to journalArticleScientificpeer-review

Open Access
1 Citation (Scopus)

Reactions of KBrF4 with platinum metals

Ivlev, S. I., Malin, A. V., Karttunen, A. J., Ostvald, R. V. & Kraus, F., 1 Feb 2019, In : Journal of Fluorine Chemistry. 218, p. 11-20 10 p.

Research output: Contribution to journalArticleScientificpeer-review

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2 Citations (Scopus)
55 Downloads (Pure)

Silicon clusters with six and seven unsubstituted vertices: Via a two-step reaction from elemental silicon

Schiegerl, L. J., Karttunen, A. J., Klein, W. & Fässler, T. F., 1 Jan 2019, In : Chemical Science. 10, 39, p. 9130-9139 10 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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2 Citations (Scopus)
35 Downloads (Pure)

Supramolecular Construction of Cyanide-Bridged Re I Diimine Multichromophores

Kisel, K. S., Melnikov, A. S., Grachova, E. V., Karttunen, A. J., Doménech-Carbó, A., Monakhov, K. Y., Semenov, V. G., Tunik, S. P. & Koshevoy, I. O., 4 Feb 2019, In : Inorganic Chemistry. 58, 3, p. 1988-2000 13 p.

Research output: Contribution to journalArticleScientificpeer-review

File
2 Citations (Scopus)
12 Downloads (Pure)

The Crystal Structures of α- and β-F 2 Revisited

Ivlev, S. I., Karttunen, A. J., Hoelzel, M., Conrad, M. & Kraus, F., 1 Jan 2019, In : Chemistry - A European Journal. 25, 13, p. 3310-3317 8 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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4 Citations (Scopus)
24 Downloads (Pure)

UF 4 and the High-Pressure Polymorph HP-UF 4

Scheibe, B., Bruns, J., Heymann, G., Sachs, M., Karttunen, A. J., Pietzonka, C., Ivlev, S. I., Huppertz, H. & Kraus, F., 28 May 2019, In : Chemistry - A European Journal. 25, 30, p. 7366-7374 9 p.

Research output: Contribution to journalArticleScientificpeer-review

File
12 Downloads (Pure)
2018

A Neutron Diffraction and Quantum-Chemical Study of [Mn(ND3)6](N3)2

Ivlev, S. I., Müller, T. G., Karttunen, A. J., Hoelzel, M. & Kraus, F., 11 Jun 2018, In : Zeitschrift fur Anorganische und Allgemeine Chemie. 644, 21, p. 1349-1353

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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40 Downloads (Pure)

Anionic Siliconoids from Zintl Phases: R3Si9 with Six and R2Si9 2− with Seven Unsubstituted Exposed Silicon Cluster Atoms (R=Si(tBu)2H)

Schiegerl, L. J., Karttunen, A. J., Klein, W. & Fässler, T. F., 20 Dec 2018, In : Chemistry - A European Journal. 24, 72, p. 19171-19174 4 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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6 Citations (Scopus)
45 Downloads (Pure)

Charged Si9 Clusters in Neat Solids and the Detection of [H2Si9]2− in Solution: A Combined NMR, Raman, Mass Spectrometric, and Quantum Chemical Investigation

Schiegerl, L. J., Karttunen, A. J., Tillmann, J., Geier, S., Raudaschl-Sieber, G., Waibel, M. & Fässler, T. F., 24 Sep 2018, In : Angewandte Chemie - International Edition. 57, 39, p. 12950-12955 6 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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12 Citations (Scopus)
68 Downloads (Pure)

Crystal Structure Prediction of Magnetic Transition-Metal Oxides by Using Evolutionary Algorithm and Hybrid DFT Methods

Kuklin, M. & Karttunen, A., 1 Nov 2018, In : Journal of Physical Chemistry C. 122, 43, p. 24949-24957

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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2 Citations (Scopus)
254 Downloads (Pure)

Crystal Structures of Solid Fluorine and Nitrogen Trifluoride

Ivlev, S., Karttunen, A., Hoelzel, M. & Kraus, F., Aug 2018, In : Acta crystallographica. Section A. 74, p. E412-E412 1 p.

Research output: Contribution to journalMeeting AbstractScientificpeer-review

Open Access
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7 Citations (Scopus)
37 Downloads (Pure)

Heterometallic Cluster-Capped Tetrahedral Assemblies with Postsynthetic Modification of the Metal Cores

Shakirova, J. R., Grachova, E. V., Gurzhiy, V. V., Thangaraj, S. K., Jänis, J., Melnikov, A. S., Karttunen, A. J., Tunik, S. P. & Koshevoy, I. O., 22 Oct 2018, In : Angewandte Chemie - International Edition. 57, 43, p. 14154-14158 5 p.

Research output: Contribution to journalArticleScientificpeer-review

10 Citations (Scopus)

Improvement of the Photophysical Performance of Platinum-Cyclometalated Complexes in Halogen-Bonded Adducts

Sivchik, V., Sarker, R. K., Liu, Z. Y., Chung, K. Y., Grachova, E. V., Karttunen, A. J., Chou, P. T. & Koshevoy, I. O., 3 Jul 2018, In : Chemistry - A European Journal. p. 11475 –11484 10 p.

Research output: Contribution to journalArticleScientificpeer-review

Luminescence Thermochromism of Gold(I) Phosphane-Iodide Complexes: A Rule or an Exception?

Glebko, N., Thuy Minh Dau, Melnikov, A. S., Grachova, E. V., Solovyev, I. V., Belyaev, A., Karttunen, A. J. & Koshevoy, I. O., 26 Feb 2018, In : CHEMISTRY: A EUROPEAN JOURNAL. 24, 12, p. 3021-3029 9 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
4 Citations (Scopus)

MoF5 revisited. A comprehensive study of MoF5

Stene, R. E., Scheibe, B., Pietzonka, C., Karttunen, A. J., Petry, W. & Kraus, F., 1 Jul 2018, In : Journal of Fluorine Chemistry. 211, p. 171-179 9 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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9 Citations (Scopus)
163 Downloads (Pure)
Open Access
File
7 Citations (Scopus)
126 Downloads (Pure)

On the Affinity between Fullerenes and Deltahedral Zintl Ions: A UV/Vis Spectroscopic Investigation

Frischhut, S., Machado de Carvalho, J. G., Karttunen, A. J. & Fässler, T. F., 2018, In : Zeitschrift fur Anorganische und Allgemeine Chemie. 644, 21, p. 1337-1343

Research output: Contribution to journalArticleScientificpeer-review

3 Citations (Scopus)

On the exfoliation and anisotropic thermal expansion of black phosphorus

Sansone, G., Karttunen, A. J., Usvyat, D., Schütz, M., Brandenburg, J. G. & Maschio, L., 1 Jan 2018, In : Chemical Communications. 54, 70, p. 9793-9796 4 p.

Research output: Contribution to journalArticleScientificpeer-review

File
5 Citations (Scopus)
33 Downloads (Pure)

Synthesis and characterization of barium hexafluoridoosmates

Ivlev, S. I., Karttunen, A. J., Buchner, M. R., Conrad, M., Ostvald, R. V. & Kraus, F., 1 Jan 2018, In : Crystals. 8, 1, 11.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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2 Citations (Scopus)
133 Downloads (Pure)

Synthesis and characterization of the pyridine—bromine trifluoride (1/1) complex, [py∙BrF3]

Ivlev, S. I., Buchner, M. R., Karttunen, A. J. & Kraus, F., 1 Nov 2018, In : Journal of Fluorine Chemistry. 215, p. 17-24 8 p.

Research output: Contribution to journalArticleScientificpeer-review

File
3 Citations (Scopus)
130 Downloads (Pure)

The [U2F12]2- Anion of Sr[U2F12]

Scheibe, B., Pietzonka, C., Mustonen, O., Karppinen, M., Karttunen, A. J., Atanasov, M., Neese, F., Conrad, M. & Kraus, F., Jan 2018, In : Angewandte Chemie. 57, 11, p. 2914-2918

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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6 Citations (Scopus)
51 Downloads (Pure)

The Cross-section of a Multi-disciplinary Project in View of Smart Textile Design Practice

Townsend, R., Karttunen, A., Karppinen, M. & Mikkonen, J., 2018, In : JOURNAL OF TEXTILE DESIGN, RESEARCH AND PRACTICE. 5, 2, p. 175-207

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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57 Downloads (Pure)

The Fluoroperovskite TlMnF3

Conrad, M., Pietzonka, C., Bernzen, J., Motta, V., Weitzel, K. M., Karttunen, A. J. & Kraus, F., 2018, In : Zeitschrift fur Anorganische und Allgemeine Chemie. 644, 22, p. 1557-1561 5 p.

Research output: Contribution to journalArticleScientificpeer-review

Open Access
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153 Downloads (Pure)