화학공학소재연구정보센터
검색결과 : 122건
No. Article
1 Synthesis of Trioxotriangulene Stable Neutral pi-Radicals Having Alkyl Substituent Groups, and Their Effects on Electronic-spin and pi-Stacking Structures
Murata T, Yokoyama M, Ueda A, Kanzaki Y, Shiomi D, Sato K, Takui T, Morita Y
Chemistry Letters, 49(1), 95, 2020
2 Magnetic Properties of Jr -Conjugated Hybrid Phenoxyl Nitroxide Radicals with Extended Jr-Spin Delocalization
Zaytseva E, Shiomi D, Ten Y, Gatilov YV, Lomanovich A, Stass D, Bogomyakov A, Yu AX, Sugisaki K, Sato K, Takui T, Bagryanskaya E, Mazhukin D
Journal of Physical Chemistry A, 124(12), 2416, 2020
3 Trityl-Aryl-Nitroxide-Based Genuinely g-Engineered Biradicals, As Studied by Dynamic Nuclear Polarization, Multifrequency ESR/ENDOR, Arbitrary Wave Generator Pulse Microwave Waveform Spectroscopy, and Quantum Chemical Calculations
Sato K, Hirao R, Timofeev I, Krumkacheva O, Zaytseva E, Rogozhnikova O, Tormyshev VM, Trukhin D, Bagryanskaya E, Gutmann T, Klimavicius C, Buntkowsky G, Sugisaki K, Nakazawa S, Matsuoka H, Toyota K, Shiomi D, Takui T
Journal of Physical Chemistry A, 123(34), 7507, 2019
4 Open-Shell and Antiaromatic Character Induced by the Highly Symmetric Geometry of the Planar Heptalene Structure: Synthesis and Characterization of a Nonalternant Isomer of Bisanthene
Konishi A, Horii K, Shiomi D, Sato K, Takui T, Yasuda M
Journal of the American Chemical Society, 141(26), 10165, 2019
5 Synthesis and Characterization of Dibenzo[&ITa&IT,&ITf&IT]pentalene: Harmonization of the Antiaromatic and Singlet Biradical Character
Konishi A, Okada Y, Nakano M, Sugisaki K, Sato K, Takui T, Yasuda M
Journal of the American Chemical Society, 139(43), 15284, 2017
6 Quantum Chemistry on Quantum Computers: A Polynomial-Time Quantum Algorithm for Constructing the Wave Functions of Open Shell Molecules
Sugisaki K, Yamamoto S, Nakazawa S, Toyota K, Sato K, Shiomi D, Takui T
Journal of Physical Chemistry A, 120(32), 6459, 2016
7 Quasi-Restricted Orbital Treatment for the Density Functional Theory Calculations of the Spin-Orbit Term of Zero-Field Splitting Tensors
Sugisaki K, Toyota K, Sato K, Shiomi D, Takui T
Journal of Physical Chemistry A, 120(49), 9857, 2016
8 Preparation and Magnetic Properties of Metal-Complexes from N-t-Butyl-N-oxidanyl-2-amino-(nitronyl nitroxide)
Furui T, Suzuki S, Kozaki M, Shiomi D, Sato K, Takui T, Okada K, Tretyakov EV, Tolstikov SE, Romanenko GV, Ovcharenko VI
Inorganic Chemistry, 53(2), 802, 2014
9 Photoswitching of a Thermally Unswitchable Molecular Magnet Cu(hfac)(2)Li-Pr Evidenced by Steady-State and Time-Resolved Electron Paramagnetic Resonance
Barskaya IY, Tretyakov EV, Sagdeev RZ, Ovcharenko VI, Bagryanskaya EG, Maryunina KY, Takui T, Sato K, Fedin MV
Journal of the American Chemical Society, 136(28), 10132, 2014
10 Complete assignment of spin sublevels in the lowest excited triplet state of corrole compounds by time-resolved EPR spectroscopy
Yamauchi S, Tanabe M, Ohba Y, Sugisaki K, Toyota K, Sato K, Takui T, Saltsman I
Chemical Physics Letters, 521, 64, 2012