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1

Spin–orbit coupling in biradicals. 5. Zero-field splitting in triplet dimethylnitrenium, dimethylphosphenium and dimethylarsenium cations

Havlas, Zdeněk, Kývala, Mojmĺr, Michl ¶ *, Josef

Journal:

Molecular Physics

Year:

2005

Language:

english

File:

PDF, 193 KB

english, 2005

2

Metal Cation−Methyl Interactions in CB 11 Me 12- Salts of Me 3 Ge + , Me 3 Sn + , and Me 3 Pb +

Zharov, Ilya, Weng, Tsu-Chien, Orendt, Anita M., Barich, Dewey H., Penner-Hahn, James, Grant, David M., Havlas, Zdenek, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2004

Language:

english

File:

PDF, 718 KB

english, 2004

3

[IEEE 2017 Smart City Symposium Prague (SCSP) - Prague, Czech Republic (2017.5.25-2017.5.26)] 2017 Smart City Symposium Prague (SCSP) - Smart rail infrastructure planning for smart cities: A prague rail hub case study

Drabek, Michal, Michl, Zdenek

Year:

2017

Language:

english

File:

PDF, 544 KB

english, 2017

4

An MS-CASPT2 Calculation of the Excited Electronic States of an Axial Difluoroborondipyrromethene (BODIPY) Dimer

Wen, Jin, Han, Bowen, Havlas, Zdeněk, Michl, Josef

Journal:

Journal of Chemical Theory and Computation

Year:

2018

Language:

english

File:

PDF, 2.36 MB

english, 2018

5

Singlet Fission Rate: Optimized Packing of a Molecular Pair. Ethylene as a Model

Zaykov, Alexandr, Felkel, Petr, Buchanan, Eric A., Jovanovic, Milena, Havenith, Remco W. A., Kathir, R K, Broer, Ria, Havlas, Zdeněk, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2019

Language:

english

File:

PDF, 7.57 MB

english, 2019

6

ChemInform Abstract: Crystal Structure of n-Bu3Sn+ CB11Me12-.

Ilya Zharov, Benjamin T. King, Zdenek Havlas, Arthur Pardi, Josef Michl

Journal:

Year:

2001

File:

PDF, 29 KB

2001

7

On the electronic structure of a dianion, a radical anion, and a neutral biradical (HB)11CCCC(BH)11 carborane dimer

Josep M. Oliva, Luis Serrano-Andrés, Zdeněk Havlas, Josef Michl

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2009

Language:

english

File:

PDF, 2.27 MB

english, 2009

8

Spin-orbit coupling in organic biradicals: zero-field splitting in triplet tetramethyleneethane

Zdeněk Havlas, Josef Michl

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1997

Language:

english

File:

PDF, 1000 KB

english, 1997

9

Search for a Small Chromophore with Efficient Singlet Fission: Biradicaloid Heterocycles

Akdag, Akin, Havlas, Zdeněk, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2012

Language:

english

File:

PDF, 1.49 MB

english, 2012

10

Toward Designed Singlet Fission: Solution Photophysics of Two Indirectly Coupled Covalent Dimers of 1,3-Diphenylisobenzofuran

Johnson, Justin C., Akdag, Akin, Zamadar, Matibur, Chen, Xudong, Schwerin, Andrew F., Paci, Irina, Smith, Millicent B., Havlas, Zdeněk, Miller, John R., Ratner, Mark A., Nozik, Arthur J., Michl, Josef

Journal:

Journal of Physical Chemistry B

Year:

2013

Language:

english

File:

PDF, 610 KB

english, 2013

11

Aromatic Substitution with Hypercloso C(BCH 3 ) 11 : A New Mechanism

Vyakaranam, Kamesh, Havlas, Zdenek, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2007

Language:

english

File:

PDF, 75 KB

english, 2007

12

Spin-Orbit Coupling in Biradicals. 4. Zero-Field Splitting in Triplet Nitrenes, Phosphinidenes, and Arsinidenes

Havlas, Zdeněk, Kývala, Mojmír, Michl, Josef

Journal:

Collection of Czechoslovak Chemical Communications

Year:

2003

Language:

english

File:

PDF, 73 KB

english, 2003

13

Two Thin Film Polymorphs of the Singlet Fission Compound 1,3-Diphenylisobenzofuran

Ryerson, Joseph L., Schrauben, Joel N., Ferguson, Andrew J., Sahoo, Subash Chandra, Naumov, Panče, Havlas, Zdenĕk, Michl, Josef, Nozik, Arthur J., Johnson, Justin C.

Journal:

The Journal of Physical Chemistry C

Year:

2014

Language:

english

File:

PDF, 4.76 MB

english, 2014

14

Crystal Structure of n- Bu 3 Sn + CB 11 Me 12-

Zharov, Ilya, King, Benjamin T., Havlas, Zdeněk, Pardi, Arthur, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2000

Language:

english

File:

PDF, 88 KB

english, 2000

15

Spin−Orbit Coupling in Biradicals. 2. 1 Ab Initio Methodology and Application to 1,1-Biradicals: Carbene and Silylene

Havlas, Zdeněk, Downing, John W., Michl, Josef

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 305 KB

english, 1998

16

Prediction of an Inverse Heavy-Atom Effect in H−C−CH 2 Br: Bromine Substituent as a π Acceptor

Havlas, Zdenek, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2002

Language:

english

File:

PDF, 77 KB

english, 2002

17

CB 11 Me 11 Boronium Ylides: Carba- closo -dodecaboranes with a Naked Boron Vertex

Zharov, Ilya, Havlas, Zdenek, Orendt, Anita M., Barich, Dewey H., Grant, David M., Fete, Matthew G., Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2006

Language:

english

File:

PDF, 391 KB

english, 2006

18

The Sixteen CB 11 H n Me 12- n - Anions with Fivefold Substitution Symmetry: Anodic Oxidation and Electronic Structure

King, Benjamin T., Körbe, Stefanie, Schreiber, Peter J., Clayton, Joshua, Němcová, Adriana, Havlas, Zdeněk, Vyakaranam, Kamesh, Fete, Matthew G., Zharov, Ilya, Ceremuga, Jason, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2007

Language:

english

File:

PDF, 477 KB

english, 2007

19

Ab initio calculation of zero-field splitting and spin-orbit coupling in ground and excited triplets of m-xylylene

Havlas, Zdeněk, Michl, Josef

Journal:

Journal of the Chemical Society Perkin Transactions 2

Year:

1999

Language:

english

File:

PDF, 121 KB

english, 1999

20

Captodatively Stabilized Biradicaloids as Chromophores for Singlet Fission

Wen, Jin, Havlas, Zdenĕk, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2015

Language:

english

File:

PDF, 1.79 MB

english, 2015

21

The Scope of Direct Alkylation of Gold Surface with Solutions of C 1 - C 4n -Alkylstannanes

Kaletova, Eva, Kohutova, Anna, Hajduch, Jan, Kaleta, Jiří, Bastl, Zdenek, Stibor, Ivan, Pospisil, Lubomir, Magnera, Thomas F., Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2015

Language:

english

File:

PDF, 10.97 MB

english, 2015

22

Spin-orbit coupling in biradicals: Structural aspects

Michl, J., Havlas, Zdeněk

Journal:

Pure & Applied Chemistry

Year:

1997

Language:

english

File:

PDF, 569 KB

english, 1997

23

Excitation Localization/Delocalization Isomerism in a Strongly Coupled Covalent Dimer of 1,3-Diphenylisobenzofuran

Schrauben, Joel N., Akdag, Akin, Wen, Jin, Havlas, Zdenek, Ryerson, Joseph L., Smith, Millie B., Michl, Josef, Johnson, Justin C.

Journal:

Journal of Physical Chemistry A

Year:

2016

Language:

english

File:

PDF, 2.87 MB

english, 2016

24

Electronic Spectra of the Tetraphenylcyclobutadienecyclopentadienylnickel(II) Cation and Radical

Craig, Peter R., Havlas, Zdeněk, Trujillo, Marianela, Rempala, Pawel, Kirby, James P., Miller, John R., Noll, Bruce C., Michl, Josef

Journal:

Journal of Physical Chemistry A

Year:

2016

Language:

english

File:

PDF, 2.15 MB

english, 2016

25

Guidance for Mutual Disposition of Chromophores for Singlet Fission

Havlas, Zdenek, Michl, Josef

Journal:

Israel Journal of Chemistry

Year:

2016

Language:

english

File:

PDF, 997 KB

english, 2016

26

AIP Conference Proceedings [AIP Publishing LLC INTERNATIONAL CONFERENCE OF COMPUTATIONAL METHODS IN SCIENCES AND ENGINEERING 2015 (ICCMSE 2015) - Athens, Greece (20–23 March 2015)] - Singlet fission: Towards efficient solar cells

Havlas, Zdeněk, Wen, Jin, Michl, Josef

Year:

2015

Language:

english

File:

PDF, 323 KB

english, 2015

27

Low-Temperature PM IRRAS of a Monolayer on Au: Peculiarities in the Spectra of C 18 D 37 SH

Mašát, Milan, Wen, Jin, Sofer, Zdenek, Michl, Josef

Journal:

Year:

2017

Language:

english

File:

PDF, 3.31 MB

english, 2017

28

Regional Flap in Head and Neck Reconstruction- Part I: Philosophy, Submental and Supraclavicular Flaps

Pink, Richard, Dvorak, Zdenek, Michl, Petr, Heinz, Petr, Tvrdy, Peter

Journal:

Year:

2017

Language:

english

File:

PDF, 518 KB

english, 2017

29

NETGRAPH – AN EFFICIENT TOOL FOR PERIODIC TIMETABLING AND CAPACITY PLANNING

Michl, Zdeněk, Drábek, Michal, Vávra, Rudolf

Journal:

Acta Polytechnica CTU Proceedings

Year:

2017

File:

PDF, 263 KB

2017

30

Singlet Fission Rate: Optimized Packing of a Molecular Pair. Ethylene as a Model

Zaykov, Alexandr, Felkel, Petr, Buchanan, Eric A., Jovanovic, Milena, Havenith, Remco W. A., Kathir, R K, Broer, Ria, Havlas, Zdeněk, Michl, Josef

Journal:

Journal of the American Chemical Society

Year:

2019

File:

PDF, 7.57 MB

2019

31

Optimal Arrangements of Tetracene Molecule Pairs for Fast Singlet Fission

Buchanan, Eric A., Havlas, Zdeněk, Michl, Josef

Journal:

Bulletin of the Chemical Society of Japan

Year:

2019

Language:

english

File:

PDF, 1.15 MB

english, 2019