Crystallography Open Database
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Searching journal of publication like 'Dalton Transactions'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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7043109 | CIF | Nb0.4 O3 Sr0.8 Ti0.6 | P m -3 m | 3.928119; 3.928119; 3.928119 90; 90; 90 | 60.6113 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7043106 | CIF | Nb0.4 O3 Sr0.8 Ti0.6 | P m -3 m | 3.93076; 3.93076; 3.93076 90; 90; 90 | 60.7337 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7043104 | CIF | Nb0.4 O3 Sr0.8 Ti0.54 Zr0.06 | P m -3 m | 3.942582; 3.942582; 3.942582 90; 90; 90 | 61.2833 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7043110 | CIF | Nb0.4 O3 Sr0.8 Ti0.54 Zr0.06 | P m -3 m | 3.943; 3.943; 3.943 90; 90; 90 | 61.3028 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7043102 | CIF | Nb0.4 O3 Sr0.8 Ti0.48 Zr0.12 | P m -3 m | 3.956674; 3.956674; 3.956674 90; 90; 90 | 61.9428 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7711109 | CIF | In Ru Sc2 | P 4/m m m | 3.3026; 3.3026; 7.052 90; 90; 90 | 76.92 | Pöttgen, Rainer; Reimann, Maximilian Kai; Kalychak, Yaroslav M.; Hulai, Nataliia; Dolsinis, Nikos; Osthues, Helena; Amirjalayer, Saeed bcc Superstructures: RE2RuIn with RE = Sc, Y, Dy-Tm and Lu Dalton Transactions, 2022 |
7711108 | CIF | Er2 In Ru | P 4/m m m | 3.4487; 3.4487; 7.5107 90; 90; 90 | 89.329 | Pöttgen, Rainer; Reimann, Maximilian Kai; Kalychak, Yaroslav M.; Hulai, Nataliia; Dolsinis, Nikos; Osthues, Helena; Amirjalayer, Saeed bcc Superstructures: RE2RuIn with RE = Sc, Y, Dy-Tm and Lu Dalton Transactions, 2022 |
7709408 | CIF | N2 V | I 4/m c m | 4.3015; 4.3015; 4.9827 90; 90; 90 | 92.194 | Asano, Shuto; Niwa, Ken; Sasaki, Takuya; Gaida, Nico Alexander; Hasegawa, Masashi High pressure synthesis and the valence state of vanadium ions for the novel transition metal pernitride, CuAl2-type VN2 Dalton Transactions, 2022 |
7049413 | CIF | Eu P Sn | P 4/n m m | 4.1239; 4.1239; 8.459 90; 90; 90 | 143.86 | Gui, Xin; Finkelstein, Gregory; Graf, David; Wei, Kaya; Zhang, Dongzhou; Baumbach, Ryan; Dera, Przemslaw; Xie, Weiwei Enhanced Néel Temperature in EuSnP under Pressure Dalton Transactions, 2019 |
7049414 | CIF | Eu P Sn | P 4/n m m | 4.2229; 4.2229; 8.6314 90; 90; 90 | 153.92 | Gui, Xin; Finkelstein, Gregory; Graf, David; Wei, Kaya; Zhang, Dongzhou; Baumbach, Ryan; Dera, Przemslaw; Xie, Weiwei Enhanced Néel Temperature in EuSnP under Pressure Dalton Transactions, 2019 |
7713484 | CIF | Ge6.568 Mn1.437 Re2.563 | I 41/a m d :1 | 5.848876; 5.848876; 4.700312 90; 90; 90 | 160.795 | Khalaniya, Roman A.; Verchenko, Valeriy; Bogach, Alexey; Likhanov, Maxim; Shevelkov, Andrei V. Itinerant ferromagnet Re4−xMnxGe7−δ (x = 0.9–1.5, δ = 0.42–0.44) with incommensurate chimney-ladder structure stabilised at ambient pressure Dalton Transactions, 2023 |
7713485 | CIF | Ge6.574 Mn0.91 Re3.09 | I 41/a m d :1 | 5.86034; 5.86034; 4.70446 90; 90; 90 | 161.568 | Khalaniya, Roman A.; Verchenko, Valeriy; Bogach, Alexey; Likhanov, Maxim; Shevelkov, Andrei V. Itinerant ferromagnet Re4−xMnxGe7−δ (x = 0.9–1.5, δ = 0.42–0.44) with incommensurate chimney-ladder structure stabilised at ambient pressure Dalton Transactions, 2023 |
7012864 | CIF | Ca2 Cr N3 | P -1 | 5.5565; 5.7202; 6.3282 72.619; 68.012; 63.969 | 165.39 | Bailey, Mark S.; DiSalvo, Francis J. Cr(v)?Cr(v) dimers in Ae4[Cr2N6] (Ae = Ca and Sr) Dalton Transactions, 2003, 2621 |
9017441 | CIF | Fe H Li O5 P | P -1 | 5.3528; 7.2896; 5.1187 109.359; 97.733; 106.359 | 174.984 | Marx, N.; Croguennec, L.; Carlier, D.; Wattiaux, A.; Le Cras, F.; Suard, E.; Delmas, C. The structure of tavorite LiFePO4(OH) from diffraction and GGA + U studies and its preliminary electrochemical characterization Dalton Transactions, 2010, 39, 5108-5116 |
7711030 | CIF | B2 O5 Th | P 1 21/m 1 | 4.2535; 6.8733; 6.3242 90; 106.316; 90 | 177.446 | Hao, Yucheng; Murphy, Gabriel L.; Kegler, Philip; Li, Yan; Kowalski, Piotr M.; Blouin, Simon; Zhang, Yang; Wang, Shuao; Robben, Lars; Gesing, Thorsten M.; Alekseev, Evgeny V. Understanding the role of flux, pressure and temperature on polymorphism in ThB2O5 Dalton Transactions, 2022 |
7012865 | CIF | Cr N3 Sr2 | P -1 | 5.7183; 5.9536; 6.659 72.718; 68.022; 64.436 | 187.14 | Bailey, Mark S.; DiSalvo, Francis J. Cr(v)?Cr(v) dimers in Ae4[Cr2N6] (Ae = Ca and Sr) Dalton Transactions, 2003, 2621 |
7714013 | CIF | K2 O8 P2 Rb Sc | P -3 m 1 | 5.4662; 5.4662; 7.7027 90; 90; 120 | 199.32 | Zhou, Jingfang; Gong, Pifu; Xia, Mingjun; Wu, Qian Co-substitution Design: A New Glaserite-type Rare-earth Phosphate K2RbSc(PO4)2 with High Structural Tolerance Dalton Transactions, 2023 |
7708714 | CIF | C2 H8 Fe I2 O2 | P -1 | 4.119; 6.285; 7.831 91.64; 92.5; 95.76 | 201.4 | Reiß, Andreas; Donsbach, Carsten; Feldmann, Claus Insights into the naphthalenide-driven synthesis and reactivity of zerovalent iron nanoparticles Dalton Transactions, 2021 |
7708870 | CIF | Cu H4 Na2 O8 Se2 | P -1 | 5.1927; 5.9081; 7.5358 103.914; 104.661; 105.325 | 203.67 | Huang, Xing; Zhao, Zhiying; Wang, Yanqi; Zhang, Mengsi; He, Zhangzhen Synthesis, structure and magnetic properties of two new spin-chain compounds Ca2Ni(HSeO3)2(SeO3)2 and Na2Cu(SeO3)2·2H2O Dalton Transactions, 2021 |
7713549 | CIF | C Al Co2 Nd2 | I m m m | 4.1168; 6.1131; 8.792 90; 90; 90 | 221.26 | Nesterenko, Sergey N.; Tursina, Anna; Kuznetsov, Alexey N. Extending interstitial tetrelides into carbides: synthesis, crystal, and electronic structure of RE2Co2AlC (RE=La, Pr, Nd) Dalton Transactions, 2023 |
7713550 | CIF | C Al Co2 Pr2 | I m m m | 4.129; 6.1152; 8.844 90; 90; 90 | 223.31 | Nesterenko, Sergey N.; Tursina, Anna; Kuznetsov, Alexey N. Extending interstitial tetrelides into carbides: synthesis, crystal, and electronic structure of RE2Co2AlC (RE=La, Pr, Nd) Dalton Transactions, 2023 |
7043489 | CIF | Cl3 Cu3 Gd H6 O6 | P -3 m 1 | 6.7982; 6.7982; 5.6062 90; 90; 120 | 224.38 | Sun, Wei; Huang, Ya-Xi; Pan, Yuanming; Mi, Jin-Xiao Strong spin frustration and negative magnetization in LnCu3(OH)6Cl3 (Ln = Nd and Sm) with triangular lattices: The effects of lanthanides Dalton Trans., 2017 |
7032247 | CIF | As4 K N3 O6 | P 6/m m m | 5.2425; 5.2425; 9.4865 90; 90; 120 | 225.79 | Guńka, Piotr A; Kraszewski, Karol; Chen, Yu-Sheng; Zachara, Janusz The structure and energetics of arsenic(iii) oxide intercalated by ionic azides. Dalton transactions, 2014, 43, 12776-12783 |
7701847 | CIF | Cr Li Rb S2 | I 4/m m m | 4.18; 4.18; 12.9501 90; 90; 90 | 226.27 | Sun, Xiaoning; Song, Yangpeng; Deng, Jun; Jin, Shifeng; Chen, Xiaolong New layered chromium chalcogenides CsLiCrSe2, RbLiCrS2 and CsLiCrS2: structure and properties Dalton Transactions, 2019 |
7032248 | CIF | As4 K N3 O6 | P 6/m m m | 5.2429; 5.2429; 9.5072 90; 90; 120 | 226.32 | Guńka, Piotr A; Kraszewski, Karol; Chen, Yu-Sheng; Zachara, Janusz The structure and energetics of arsenic(iii) oxide intercalated by ionic azides. Dalton transactions, 2014, 43, 12776-12783 |
7043488 | CIF | Cl3 Cu3 H6 O6 Sm | P -3 m 1 | 6.8227; 6.8227; 5.6249 90; 90; 120 | 226.76 | Sun, Wei; Huang, Ya-Xi; Pan, Yuanming; Mi, Jin-Xiao Strong spin frustration and negative magnetization in LnCu3(OH)6Cl3 (Ln = Nd and Sm) with triangular lattices: The effects of lanthanides Dalton Trans., 2017 |
7032249 | CIF | As4 K N3 O6 | P 6/m m m | 5.246; 5.246; 9.535 90; 90; 120 | 227.25 | Guńka, Piotr A; Kraszewski, Karol; Chen, Yu-Sheng; Zachara, Janusz The structure and energetics of arsenic(iii) oxide intercalated by ionic azides. Dalton transactions, 2014, 43, 12776-12783 |
7043374 | CIF | C H N4 O Rb | P -1 | 4.948; 7.1191; 7.4189 67.289; 71.888; 89.451 | 227.3 | He, Piao; Wu, Le; Wu, Jin-Ting; Yin, Xin; Gozin, Michael; Zhang, Jian-Guo Alkali and alkaline earth metal salts of tetrazolone: structurally interesting and excellently thermostable Dalton Trans., 2017 |
7032250 | CIF | As4 K N3 O6 | P 6/m m m | 5.2469; 5.2469; 9.56 90; 90; 120 | 227.93 | Guńka, Piotr A; Kraszewski, Karol; Chen, Yu-Sheng; Zachara, Janusz The structure and energetics of arsenic(iii) oxide intercalated by ionic azides. Dalton transactions, 2014, 43, 12776-12783 |
7032251 | CIF | As4 K N3 O6 | P 6/m m m | 5.2472; 5.2472; 9.589 90; 90; 120 | 228.64 | Guńka, Piotr A; Kraszewski, Karol; Chen, Yu-Sheng; Zachara, Janusz The structure and energetics of arsenic(iii) oxide intercalated by ionic azides. Dalton transactions, 2014, 43, 12776-12783 |
7032246 | CIF | As4 H4 N4 O6 | P 6/m m m | 5.2354; 5.2354; 9.6787 90; 90; 120 | 229.75 | Guńka, Piotr A; Kraszewski, Karol; Chen, Yu-Sheng; Zachara, Janusz The structure and energetics of arsenic(iii) oxide intercalated by ionic azides. Dalton transactions, 2014, 43, 12776-12783 |
7043490 | CIF | Cl3 Cu3 H6 Nd O6 | P -3 m 1 | 6.8645; 6.8645; 5.6391 90; 90; 120 | 230.12 | Sun, Wei; Huang, Ya-Xi; Pan, Yuanming; Mi, Jin-Xiao Strong spin frustration and negative magnetization in LnCu3(OH)6Cl3 (Ln = Nd and Sm) with triangular lattices: The effects of lanthanides Dalton Trans., 2017 |
7715808 | CIF | As4 Li9.33 Si0.67 | F m -3 m | 6.131; 6.131; 6.131 90; 90; 90 | 230.46 | Schmid, Martin; Wegner, Florian; De Giorgi, Claudia; Pielnhofer, Florian; Pfitzner, Arno The cubic structure of Li3As stabilized by substitution – Li8TtAs4 (Tt = Si, Ge) and Li14TtAs6 (Tt = Si, Ge, Sn) and their lithium ion conductivity Dalton Transactions, 2024 |
7713548 | CIF | C Al Co2 La2 | I m m m | 4.1841; 6.1161; 9.091 90; 90; 90 | 232.64 | Nesterenko, Sergey N.; Tursina, Anna; Kuznetsov, Alexey N. Extending interstitial tetrelides into carbides: synthesis, crystal, and electronic structure of RE2Co2AlC (RE=La, Pr, Nd) Dalton Transactions, 2023 |
7713241 | CIF | C7 H6 K N3 O2 S | P 1 | 4.2204; 6.0284; 9.659 84.14; 80.32; 78.44 | 236.74 | Gond, M. K.; Rai, Nilesh; Chandra, Brijesh; Gautam, Vibhav; Garai, Somenath; Butcher, R. J.; Bharty, Manoj K. Isolation of potassium salt of oxadiazole-2-thione and In Vitro Anticancer Activities of its Cu(II) and Zn(II) complexes against MDA-MB-231 human breast carcinoma cells Dalton Transactions, 2023 |
7715809 | CIF | As4 Li9.33 Sn0.67 | F m -3 m | 6.193; 6.193; 6.193 90; 90; 90 | 237.52 | Schmid, Martin; Wegner, Florian; De Giorgi, Claudia; Pielnhofer, Florian; Pfitzner, Arno The cubic structure of Li3As stabilized by substitution – Li8TtAs4 (Tt = Si, Ge) and Li14TtAs6 (Tt = Si, Ge, Sn) and their lithium ion conductivity Dalton Transactions, 2024 |
7701845 | CIF | Cr Cs Li S2 | I 4/m m m | 4.26786; 4.26786; 13.2824 90; 90; 90 | 241.934 | Sun, Xiaoning; Song, Yangpeng; Deng, Jun; Jin, Shifeng; Chen, Xiaolong New layered chromium chalcogenides CsLiCrSe2, RbLiCrS2 and CsLiCrS2: structure and properties Dalton Transactions, 2019 |
7043105 | CIF | Nb0.4 O3 Sr0.8 Ti0.48 Zr0.12 | I 4/m c m | 5.595; 5.595; 7.9158 90; 90; 90 | 247.8 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7712660 | CIF | Fe1.392 Nb Te3 | P 1 21/m 1 | 7.401; 3.6508; 9.9938 90; 108.874; 90 | 255.51 | Verchenko, Valeriy; Stepanova, Anna V.; Bogach, Alexey; Kirsanova, Maria; Shevelkov, Andrei V. Cleavable crystals, crystal structure, and magnetic properties of the NbFe1+xTe3 layered van der Waals telluride Dalton Transactions, 2023 |
7042858 | CIF | C H4 Cl2 Si | P -1 | 5.9079; 6.3658; 8.112 103.99; 96.08; 116.596 | 256.52 | Wagler, Jörg; Gericke, Robert Molecular structures of various alkyldichlorosilanes in the solid state Dalton Trans., 2017 |
7043111 | CIF | Nb0.4 O3 Sr0.8 Ti0.24 Zr0.36 | I 4/m c m | 5.664962; 5.664962; 8.01659 90; 90; 90 | 257.267 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7043103 | CIF | Nb0.4 O3 Sr0.8 Ti0.24 Zr0.36 | I 4/m c m | 5.6682; 5.6682; 8.017 90; 90; 90 | 257.57 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7043107 | CIF | Nb0.4 O3 Sr0.8 Ti0.12 Zr0.48 | I 4/m c m | 5.694282; 5.694282; 8.077236 90; 90; 90 | 261.903 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7044476 | CIF | Ag F2 | P b c n | 5.476; 8.331; 5.787 90; 90; 90 | 264 | Grzelak, A.; Gawraczyński, J.; Jaroń, T.; Kurzydłowski, D.; Mazej, Z.; Leszczyński, P. J.; Prakapenka, V. B.; Derzsi, M.; Struzhkin, V. V.; Grochala, W. Metal fluoride nanotubes featuring square-planar building blocks in a high-pressure polymorph of AgF2 Dalton Trans., 2017 |
7002869 | CIF | As Ce F2 H4 N O4 | P 1 21/m 1 | 6.7758; 6.0181; 7.1315 90; 113.832; 90 | 266.009 | Rouse, Jessica; Weller, Mark T. Cerium(IV) fluoride and fluoride-arsenate frameworks Dalton Transactions, 2009, 10330-10337 |
7043112 | CIF | Nb0.4 O3 Sr0.8 Zr0.6 | I 4/m c m | 5.725077; 5.725077; 8.132035 90; 90; 90 | 266.54 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7043108 | CIF | Nb0.4 O3 Sr0.8 Zr0.6 | I 4/m c m | 5.72625; 5.72625; 8.13217 90; 90; 90 | 266.653 | Whittle, Thomas A.; Brant, William R.; Hester, James R.; Gu, Qinfen; Schmid, Siegbert Tailoring phase transition temperatures in perovskites via A-site vacancy generation Dalton Trans., 2017 |
7036919 | CIF HKL | Ca2 La Nb O6 | P 1 21/n 1 | 5.61386; 5.86564; 8.11572 90; 90.1608; 90 | 267.24 | Jicheng Zhu; Zhiguo Xia; Yuanyuan Zhang; Maxim S. Molokeev; Quanlin Liu Structural phase transitions and photoluminescence properties of Eu3+ doped Ca(2-x)BaxLaNbO6 phosphors Dalton Transactions, 2015, 44, 18536-18543 |
7036920 | CIF HKL | Ba0.6 Ca3.4 La2 Nb2 O12 | P 1 21/n 1 | 5.62249; 5.86915; 8.12955 90; 90.1512; 90 | 268.27 | Jicheng Zhu; Zhiguo Xia; Yuanyuan Zhang; Maxim S. Molokeev; Quanlin Liu Structural phase transitions and photoluminescence properties of Eu3+ doped Ca(2-x)BaxLaNbO6 phosphors Dalton Transactions, 2015, 44, 18536-18543 |
7012468 | CIF | C4 H4 O4 Zn | C 1 2 1 | 7.585; 5.9843; 6.253 90; 108.51; 90 | 269.15 | Bowden, Thomas A.; Milton, Heather L.; Slawin, Alexandra M. Z.; Lightfoot, Philip Hydrothermal syntheses and crystal structures of three zinc succinates: Zn(C4H4O4)-α, Zn(C4H4O4)-β and K2Zn(C4H4O4)2 Dalton Transactions, 2003, 936 |
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