Crystallography Open Database
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Searching journal of publication like 'Chemistry of Materials'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4003995 | CIF | C13 H20 N2 O4 S | P 1 21 1 | 9.1142; 12.0574; 13.2549 90; 90.651; 90 | 1456.53 | Xu, Lei; Mu, Xin; Chen, Xiao-Gang; Zhang, Han-Yue; Xiong, Ren-Gen Organic Enantiomeric Ferroelectrics with High Piezoelectric Performance: Imidazolium l- and d-Camphorsulfonate Chemistry of Materials, 2021 |
| 4003996 | CIF | C4 H8 N2 O3 S | P b c a | 8.0054; 11.1571; 16.1757 90; 90; 90 | 1444.77 | Xu, Lei; Mu, Xin; Chen, Xiao-Gang; Zhang, Han-Yue; Xiong, Ren-Gen Organic Enantiomeric Ferroelectrics with High Piezoelectric Performance: Imidazolium l- and d-Camphorsulfonate Chemistry of Materials, 2021 |
| 4003997 | CIF | C5 H10 N2 O3 S | C 1 2/c 1 | 12.2768; 10.0322; 13.7525 90; 99.64; 90 | 1669.89 | Xu, Lei; Mu, Xin; Chen, Xiao-Gang; Zhang, Han-Yue; Xiong, Ren-Gen Organic Enantiomeric Ferroelectrics with High Piezoelectric Performance: Imidazolium l- and d-Camphorsulfonate Chemistry of Materials, 2021 |
| 4003998 | CIF | C13 H20 N2 O4 S | P 1 21 1 | 9.1224; 12.0569; 13.3229 90; 90.602; 90 | 1465.28 | Xu, Lei; Mu, Xin; Chen, Xiao-Gang; Zhang, Han-Yue; Xiong, Ren-Gen Organic Enantiomeric Ferroelectrics with High Piezoelectric Performance: Imidazolium l- and d-Camphorsulfonate Chemistry of Materials, 2021 |
| 4003999 | CIF | C16 H17 Cd N6 O7 | P 1 21/n 1 | 10.0457; 14.95; 13.2054 90; 97.794; 90 | 1964.9 | Sharma, Shivani; Mukherjee, Soumya; Desai, Aamod V.; Vandichel, Matthias; Dam, Gourab K.; Jadhav, Ashwini; Kociok-Köhn, Gabriele; Zaworotko, Michael J.; Ghosh, Sujit K. Efficient Capture of Trace Acetylene by an Ultramicroporous Metal‒Organic Framework with Purine Binding Sites Chemistry of Materials, 2021 |
| 4004000 | CIF | I2 Re6 S4 Se4 | P 1 21/n 1 | 6.4555; 11.848; 10.308 90; 99.2; 90 | 778.3 | Laing, Craig C.; Shen, Jiahong; Chica, Daniel G.; Cuthriell, Shelby A.; Schaller, Richard D.; Wolverton, Chris; Kanatzidis, Mercouri G. Photoluminescent Re6Q8I2 (Q = S, Se) Semiconducting Cluster Compounds Chemistry of Materials, 2021 |
| 4004001 | CIF | I2 Re6 Se8 | P 1 21/n 1 | 6.5735; 12.029; 10.402 90; 99.63; 90 | 810.9 | Laing, Craig C.; Shen, Jiahong; Chica, Daniel G.; Cuthriell, Shelby A.; Schaller, Richard D.; Wolverton, Chris; Kanatzidis, Mercouri G. Photoluminescent Re6Q8I2 (Q = S, Se) Semiconducting Cluster Compounds Chemistry of Materials, 2021 |
| 4004002 | CIF | I2 Re6 S8 | P 1 21/n 1 | 6.3649; 11.607; 10.177 90; 98.77; 90 | 743.1 | Laing, Craig C.; Shen, Jiahong; Chica, Daniel G.; Cuthriell, Shelby A.; Schaller, Richard D.; Wolverton, Chris; Kanatzidis, Mercouri G. Photoluminescent Re6Q8I2 (Q = S, Se) Semiconducting Cluster Compounds Chemistry of Materials, 2021 |
| 4004003 | CIF | C21 Bi2 Br9 N3 | C m c m | 10.5812; 17.5448; 22.7429 90; 90; 90 | 4222.1 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4004004 | CIF | C15 Bi2 Br9 N3 | C m c m | 8.8008; 19.811; 21.429 90; 90; 90 | 3736.2 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4004005 | CIF | C21 H0 Bi2 Br9 N3 | P 63/m m c | 10.4505; 10.4505; 23.2226 90; 90; 120 | 2196.4 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4004006 | CIF | C8 H24 Bi Br5 N2 | P 1 21/c 1 | 22.5815; 8.7923; 24.089 90; 121.745; 90 | 4067.2 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4004007 | CIF | C18 Bi2 Br9 N3 | P b c n | 22.4702; 18.4743; 19.2456 90; 90; 90 | 7989.3 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4004008 | CIF | C15 H42 Bi2 Br9 N3 | P n m a | 19.5801; 21.328; 8.7346 90; 90; 90 | 3647.6 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4004009 | CIF | C18 H48 Bi2 Br9 N3 | P b c n | 23.0597; 18.4426; 18.2352 90; 90; 90 | 7755.1 | Zhang, Zhi-Xu; Su, Chang-Yuan; Li, Jie; Song, Xian-Jiang; Fu, Da-Wei; Zhang, Yi Ferroelastic Hybrid Bismuth Bromides with Dual Dielectric Switches Chemistry of Materials, 2021 |
| 4004010 | CIF | C12 H10 Co N4 O4 | P n n 2 | 12.2; 6.783; 10.707 90; 90; 90 | 886 | Kang, Minjung; Kang, Dong Won; Choe, Jong Hyeak; Kim, Hyojin; Kim, Dae Won; Park, Hyein; Hong, Chang Seop A Robust Hydrogen-Bonded Metal‒Organic Framework with Enhanced Ethane Uptake and Selectivity Chemistry of Materials, 2021 |
| 4004011 | CIF | O14 P U | P 4/n m m :2 | 6.9932; 6.9932; 8.908 90; 90; 90 | 435.64 | Wang, Xiaoze; Song, Enhai; Qin, Lianjie; Gui, Daxiang; Xu, Zhijun; Xie, Jian; Lei, Min; Zhang, Hongfa; Wang, Yanlong; Wang, Yaxing; Xia, Zhiguo; Liu, Wei; Du, Wei; Wang, Shuao Fabrication of a Wide Color Gamut pc-WLED Surpassing 107% NTSC Based on a Robust Luminescent Uranyl Phosphate Chemistry of Materials, 2021 |
| 4004012 | CIF | Ba3 Ge3 O14 Te Zn2 | P 3 2 1 | 8.616; 8.616; 5.198 90; 90; 120 | 334.2 | Chen, Kaichuang; Lin, Chensheng; Zhang, Shengzi; Peng, Guang; Chen, Yu; Zhao, Dan; Fan, Huixin; Yang, Shunda; Wen, Xin; Luo, Min; Lin, Zheshuai; Ye, Ning A3Te(Zn2Ge)Ge2O14 (A = Sr, Ba, and Pb): New Langasite Mid-infrared Nonlinear Optical Materials by Rational Chemical Substitution Chemistry of Materials, 2021 |
| 4004013 | CIF | Ge3 O14 Sr3 Te Zn2 | P 3 2 1 | 8.3223; 8.3223; 5.0551 90; 90; 120 | 303.21 | Chen, Kaichuang; Lin, Chensheng; Zhang, Shengzi; Peng, Guang; Chen, Yu; Zhao, Dan; Fan, Huixin; Yang, Shunda; Wen, Xin; Luo, Min; Lin, Zheshuai; Ye, Ning A3Te(Zn2Ge)Ge2O14 (A = Sr, Ba, and Pb): New Langasite Mid-infrared Nonlinear Optical Materials by Rational Chemical Substitution Chemistry of Materials, 2021 |
| 4004014 | CIF | Ge3 O14 Pb3 Te Zn2 | P 3 2 1 | 8.5194; 8.5194; 5.1235 90; 90; 120 | 322.04 | Chen, Kaichuang; Lin, Chensheng; Zhang, Shengzi; Peng, Guang; Chen, Yu; Zhao, Dan; Fan, Huixin; Yang, Shunda; Wen, Xin; Luo, Min; Lin, Zheshuai; Ye, Ning A3Te(Zn2Ge)Ge2O14 (A = Sr, Ba, and Pb): New Langasite Mid-infrared Nonlinear Optical Materials by Rational Chemical Substitution Chemistry of Materials, 2021 |
| 4004015 | CIF | C16 H40 Bi2 Br12 N4 O4 Rb2 | P 1 | 8.7893; 14.0924; 9.6968 93.982; 67.441; 92.837 | 1106.15 | He, Lei; Shi, Ping-Ping; Zhou, Lin; Liu, Zhi-Bo; Zhang, Wen; Ye, Qiong Coexisting Ferroelectric and Ferroelastic Orders in Rare 3D Homochiral Hybrid Bimetal Halides Chemistry of Materials, 2021 |
| 4004016 | CIF | C8 H20 Bi Br6 N2 O2 Rb | P 1 21 1 | 8.8725; 14.4071; 9.6558 90; 113.403; 90 | 1132.7 | He, Lei; Shi, Ping-Ping; Zhou, Lin; Liu, Zhi-Bo; Zhang, Wen; Ye, Qiong Coexisting Ferroelectric and Ferroelastic Orders in Rare 3D Homochiral Hybrid Bimetal Halides Chemistry of Materials, 2021 |
| 4004017 | CIF | C6 H16 Bi I5 N2 | P 1 21 1 | 10.24; 8.4579; 21.347 90; 90.14; 90 | 1848.8 | Li, Xiaotong; Traoré, Boubacar; Kepenekian, Mikaël; Li, Linda; Stoumpos, Constantinos C.; Guo, Peijun; Even, Jacky; Katan, Claudine; Kanatzidis, Mercouri G. Bismuth/Silver-Based Two-Dimensional Iodide Double and One-Dimensional Bi Perovskites: Interplay between Structural and Electronic Dimensions Chemistry of Materials, 2021 |
| 4004018 | CIF | C12 H22 Ag Bi I8 N4 O | P 1 | 8.5577; 9.7387; 18.5585 86.3032; 88.2019; 88.8251 | 1542.44 | Li, Xiaotong; Traoré, Boubacar; Kepenekian, Mikaël; Li, Linda; Stoumpos, Constantinos C.; Guo, Peijun; Even, Jacky; Katan, Claudine; Kanatzidis, Mercouri G. Bismuth/Silver-Based Two-Dimensional Iodide Double and One-Dimensional Bi Perovskites: Interplay between Structural and Electronic Dimensions Chemistry of Materials, 2021 |
| 4004019 | CIF | C6 H10 Bi I5 N2 | P 1 21 1 | 10.93; 9.0996; 17.651 90; 90.29; 90 | 1755.5 | Li, Xiaotong; Traoré, Boubacar; Kepenekian, Mikaël; Li, Linda; Stoumpos, Constantinos C.; Guo, Peijun; Even, Jacky; Katan, Claudine; Kanatzidis, Mercouri G. Bismuth/Silver-Based Two-Dimensional Iodide Double and One-Dimensional Bi Perovskites: Interplay between Structural and Electronic Dimensions Chemistry of Materials, 2021 |
| 4004020 | CIF | C6 H10 Bi I5 N2 | C 1 c 1 | 19.55; 10.108; 17.163 90; 90; 90 | 3391.6 | Li, Xiaotong; Traoré, Boubacar; Kepenekian, Mikaël; Li, Linda; Stoumpos, Constantinos C.; Guo, Peijun; Even, Jacky; Katan, Claudine; Kanatzidis, Mercouri G. Bismuth/Silver-Based Two-Dimensional Iodide Double and One-Dimensional Bi Perovskites: Interplay between Structural and Electronic Dimensions Chemistry of Materials, 2021 |
| 4004021 | CIF | C6 H16.5 Ag0.5 Bi0.5 I4 N2 O0.25 | C 1 2/c 1 | 34.988; 8.4789; 22.226 90; 96.92; 90 | 6546 | Li, Xiaotong; Traoré, Boubacar; Kepenekian, Mikaël; Li, Linda; Stoumpos, Constantinos C.; Guo, Peijun; Even, Jacky; Katan, Claudine; Kanatzidis, Mercouri G. Bismuth/Silver-Based Two-Dimensional Iodide Double and One-Dimensional Bi Perovskites: Interplay between Structural and Electronic Dimensions Chemistry of Materials, 2021 |
| 4004022 | CIF | C6 H16 Bi I5 N2 | P 1 21 1 | 12.74; 8.9285; 16.404 90; 90.09; 90 | 1865.9 | Li, Xiaotong; Traoré, Boubacar; Kepenekian, Mikaël; Li, Linda; Stoumpos, Constantinos C.; Guo, Peijun; Even, Jacky; Katan, Claudine; Kanatzidis, Mercouri G. Bismuth/Silver-Based Two-Dimensional Iodide Double and One-Dimensional Bi Perovskites: Interplay between Structural and Electronic Dimensions Chemistry of Materials, 2021 |
| 4004023 | CIF | B2 Co2 Nd | P -1 | 5.7203; 6.546; 6.7887 86.6638; 88.7402; 89.5149 | 253.705 | Powderly, Kelly M.; Guo, Shu; Mitchell Warden, Hillary E.; Nguyen, Loi T.; Cava, R. J. Metastable β-NdCo2B2: A Triclinic Polymorph with Magnetic Ordering Chemistry of Materials, 2021, 33, 6374-6382 |
| 4004024 | CIF | Bi5 Na Nb4 O18 | C m c 21 | 24.9258; 5.4638; 5.4927 90; 90; 90 | 748.05 | Kim, Kisung; Lee, Min Hyung; Ok, Kang Min Structural Origin of Very Large Second-Harmonic Generation of a Layered Perovskite, Na0.5Bi2.5Nb2O9 Chemistry of Materials, 2021, 33, 6564-6571 |
| 4004025 | CIF | Hg3 P2 S8 | A e a 2 | 16.52; 8.223; 9.293 90; 90; 90 | 1262 | Chu, Yu; Wang, Peng; Zeng, Hao; Cheng, Shichao; Su, Xin; Yang, Zhihua; Li, Junjie; Pan, Shilie Hg3P2S8: A New Promising Infrared Nonlinear Optical Material with a Large Second-Harmonic Generation and a High Laser-Induced Damage Threshold Chemistry of Materials, 2021, 33, 6514-6521 |
| 4004026 | CIF | C24 H42 Ca5 O22 S2 | P 1 21/c 1 | 10.3586; 12.474; 16.2912 90; 93.407; 90 | 2101.32 | Yin, Yu-Jie; Zhao, He; Zhang, Lingwen; Huang, Jiaxiang; Zhang, Jian-Jun; Chen, Jun; Ni, Jun; Song, Bo; Liu, Shuqin; Duan, Chunying Color-Tunable Long-Lived Room-Temperature Phosphorescence in a Coordination Polymer Based on a Nonaromatic Ligand and Its Phosphor/Coordination Polymer-Doped Systems Chemistry of Materials, 2021, 33, 7272-7282 |
| 4004027 | CIF | C34 H29 Cd N9 O6 | P -1 | 20.5838; 15.8576; 16.9689 84.446; 85.324; 69.545 | 5158.5 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004028 | CIF | C40 H39 Cd N9 O7 | P 1 2/c 1 | 20.6808; 15.8316; 16.3301 90; 94.133; 90 | 5332.74 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004029 | CIF | C20 H18 N4 O | P 1 21/c 1 | 10.7072; 9.5189; 15.7651 90; 96.508; 90 | 1596.44 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004030 | CIF | C29 H20 Cd N8 O5 | P 1 2/c 1 | 20.3536; 15.8322; 16.8859 90; 94.971; 90 | 5420.88 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004031 | CIF | C32 H27 Cd N11 O6 | P -1 | 20.4536; 15.7247; 17.0953 86.129; 85.252; 70.324 | 5154.9 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004032 | CIF | C36 H30 Cd N8 O5 | P 1 2/c 1 | 20.3536; 15.8322; 16.8859 90; 94.971; 90 | 5420.88 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004033 | CIF | C19 H16 N4 | P 1 21/c 1 | 10.6147; 9.0978; 15.2177 90; 96.57; 90 | 1459.93 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004034 | CIF | C14 H10 N4 | C 1 2/c 1 | 26.8453; 5.7386; 7.249 90; 107.645; 90 | 1064.2 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004035 | CIF | C35 H28 Cd N8 O5 | P 1 2/c 1 | 20.488; 15.7873; 16.812 90; 95.489; 90 | 5412.91 | Jędrzejowski, Damian; Pander, Marzena; Nitek, Wojciech; Bury, Wojciech; Matoga, Dariusz Turning Flexibility into Rigidity: Stepwise Locking of Interpenetrating Networks in a MOF Crystal through Click Reaction Chemistry of Materials, 2021, 33, 7509-7517 |
| 4004036 | CIF | Bi Cr O3 | C 1 2/c 1 | 9.4641; 5.479; 9.585 90; 108.568; 90 | 471.15 | Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E. Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 7 K Chemistry of Materials, 2008, 20, 3765-3769 |
| 4004037 | CIF | Bi Cr O3 | C 1 2/c 1 | 9.4621; 5.4783; 9.5832 90; 108.569; 90 | 470.9 | Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E. Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 50 K Chemistry of Materials, 2008, 20, 3765-3769 |
| 4004038 | CIF | Bi Cr O3 | C 1 2/c 1 | 9.462; 5.4781; 9.5835 90; 108.568; 90 | 470.89 | Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E. Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 80 K Chemistry of Materials, 2008, 20, 3765-3769 |
| 4004039 | CIF | Bi Cr O3 | C 1 2/c 1 | 9.4658; 5.481; 9.5879 90; 108.564; 90 | 471.56 | Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E. Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 130 K Chemistry of Materials, 2008, 20, 3765-3769 |
| 4004040 | CIF | Bi Cr O3 | P n m a | 5.54568; 7.7577; 5.42862 90; 90; 90 | 233.549 | Belik, A.A.; Iikubo, S.; Kodama, K.; Igawa, N.; Shamoto, S.; Takayama-Muromachi, E. Neutron powder diffraction study on the crystal and magnetic structures of BiCrO3 :At 470 K perovskite structure Chemistry of Materials, 2008, 20, 3765-3769 |
| 4004041 | CIF | O3 Pb V | P 4 m m | 3.80329; 3.80329; 4.64989 90; 90; 90 | 67.261 | Belik, A.A.; Azuma, M.; Saito, T.; Shimakawa, Y.; Takano, M. Crystallographic features and tetragonal phase stability of PbVO3, a new memmber of PbTiO3 family : At 90 K Chemistry of Materials, 2005, 17, 269-273 |
| 4004042 | CIF | O3 Pb V | P 4 m m | 3.80391; 3.80391; 4.6768 90; 90; 90 | 67.672 | Belik, A.A.; Azuma, M.; Saito, T.; Shimakawa, Y.; Takano, M. Crystallographic features and tetragonal phase stability of PbVO3, a new memmber of PbTiO3 family : At 300 K Chemistry of Materials, 2005, 17, 269-273 |
| 4004043 | CIF | O3 Pb V | P 4 m m | 3.80721; 3.80721; 4.69819 90; 90; 90 | 68.0995 | Belik, A.A.; Azuma, M.; Saito, T.; Shimakawa, Y.; Takano, M. Crystallographic features and tetragonal phase stability of PbVO3, a new memmber of PbTiO3 family : At 530 K Chemistry of Materials, 2005, 17, 269-273 |
| 4004044 | CIF | C8 H12 Cu3 N16 Na | I 41/a c d :2 | 16.378; 16.378; 27.376 90; 90; 90 | 7343 | Lu, Ying-Bing; Liao, Ya-Qing; Dong, Lu; Zhu, Shui-Dong; Wen, He-Rui; Huang, Jing; Dai, Xue-Xun; Lian, Ping; Jiang, Xiao-Ming; Li, Rong; Xie, Yong-Rong Ultra-Stable Metal–Organic Framework with Concurrent High Proton Conductivity and Fluorescence Sensing for Nitrobenzene Chemistry of Materials, 2021, 33, 7858-7868 |
| 4004045 | CIF | C41 H18 Cu2 N2 O11 | F m -3 m | 46.14; 46.14; 46.14 90; 90; 90 | 98227 | Walenszus, Francesco; Evans, Jack D.; Bon, Volodymyr; Schwotzer, Friedrich; Senkovska, Irena; Kaskel, Stefan Integration of Fluorescent Functionality into Pressure-Amplifying Metal–Organic Frameworks Chemistry of Materials, 2021, 33, 7964-7971 |
| 4004046 | CIF | C41 H18 N2 O11 Zn2 | F m -3 m | 46.47; 46.47; 46.47 90; 90; 90 | 100350 | Walenszus, Francesco; Evans, Jack D.; Bon, Volodymyr; Schwotzer, Friedrich; Senkovska, Irena; Kaskel, Stefan Integration of Fluorescent Functionality into Pressure-Amplifying Metal–Organic Frameworks Chemistry of Materials, 2021, 33, 7964-7971 |
| 4004047 | CIF | C41 H18 Co2 N2 O11 | F m -3 m | 46.52; 46.52; 46.52 90; 90; 90 | 100674 | Walenszus, Francesco; Evans, Jack D.; Bon, Volodymyr; Schwotzer, Friedrich; Senkovska, Irena; Kaskel, Stefan Integration of Fluorescent Functionality into Pressure-Amplifying Metal–Organic Frameworks Chemistry of Materials, 2021, 33, 7964-7971 |
| 4004048 | CIF | Ba0.25 Ca3.42 Mg1.18 Sb11 Yb10.15 | I 41/a c d :2 | 16.6247; 16.6247; 22.222 90; 90; 90 | 6141.7 | Perez, Christopher J.; Cerretti, Giacomo; Wille, Elizabeth L. K.; Devlin, Kasey P.; Grewal, Navtej S.; Justl, Andrew P.; Wood, Maxwell; Bux, Sabah K.; Kauzlarich, Susan M. Evolution of Thermoelectric Properties in the Triple Cation Zintl Phase: Yb13–xCaxBaMgSb11 (x = 1–6) Chemistry of Materials, 2021, 33, 8059-8069 |
| 4004049 | CIF | Cr K Se2 | C 1 2/m 1 | 6.5845; 3.8012; 7.7116 90; 106.548; 90 | 185.019 | Song, Xiaoyu; Schneider, Sarah N.; Cheng, Guangming; Khoury, Jason F.; Jovanovic, Milena; Yao, Nan; Schoop, Leslie M. Kinetics and Evolution of Magnetism in Soft-Chemical Synthesis of CrSe2 from KCrSe2 Chemistry of Materials, 2021, 33, 8070-8078 |
| 4004050 | CIF | C14 H24 Cl2 Fe2 N2 O4 | P -3 1 m | 13.5717; 13.5717; 9.9759 90; 90; 120 | 1591.3 | Wang, Yiran; Ziebel, Michael E.; Sun, Lei; Gish, J. Tyler; Pearson, Tyler J.; Lu, Xue-Zeng; Thorarinsdottir, Agnes E.; Hersam, Mark C.; Long, Jeffrey R.; Freedman, Danna E.; Rondinelli, James M.; Puggioni, Danilo; Harris, T. David Strong Magnetocrystalline Anisotropy Arising from Metal–Ligand Covalency in a Metal–Organic Candidate for 2D Magnetic Order Chemistry of Materials, 2021, 33, 8712-8721 |
| 4004051 | CIF | N O2 Si Y | C 1 2/c 1 | 6.9973; 12.147; 18.2554 90; 90.7345; 90 | 1551.5 | Kitagawa, Yuuki; Ueda, Jumpei; Fujii, Kotaro; Yashima, Masatomo; Funahashi, Shiro; Nakanishi, Takayuki; Takeda, Takashi; Hirosaki, Naoto; Hongo, Kenta; Maezono, Ryo; Tanabe, Setsuhisa Site-Selective Eu3+ Luminescence in the Monoclinic Phase of YSiO2N Chemistry of Materials, 2021, 33, 8873-8885 |
| 4004052 | CIF | Cd Cl Ga9 K4 S16 | P 1 | 8.4328; 9.8807; 9.9005 68.215; 74.887; 84.956 | 739.49 | Pei, Shao-Min; Liu, Bin-Wen; Jiang, Xiao-Ming; Zou, Ya-Qian; Chen, Wen-Fa; Yan, Qiu-Nan; Guo, Guo-Cong Superior Infrared Nonlinear Optical Performance Achieved by Synergetic Functional Motif and Vacancy Site Modulations Chemistry of Materials, 2021, 33, 8831-8837 |
| 4004053 | CIF | Cd Cl Ga9 K4 Se16 | P 1 | 8.772; 10.2955; 10.3146 68.356; 74.92; 84.93 | 836.01 | Pei, Shao-Min; Liu, Bin-Wen; Jiang, Xiao-Ming; Zou, Ya-Qian; Chen, Wen-Fa; Yan, Qiu-Nan; Guo, Guo-Cong Superior Infrared Nonlinear Optical Performance Achieved by Synergetic Functional Motif and Vacancy Site Modulations Chemistry of Materials, 2021, 33, 8831-8837 |
| 4004054 | CIF | C45 H46 Co6 O34 | P 21 21 2 | 22.57; 28.68; 10.94 90; 90; 90 | 7082 | Qazvini, Omid T.; Scott, Victoria-Jayne; Bondorf, Linda; Ducamp, Maxime; Hirscher, Michael; Coudert, François-Xavier; Telfer, Shane G. Flexibility of a Metal–Organic Framework Enhances Gas Separation and Enables Quantum Sieving Chemistry of Materials, 2021, 33, 8886-8894 |
| 4004055 | CIF | Mn2 Na6 O24 P6 Ti2 | C 1 2 1 | 15.2567; 8.8952; 8.8314 90; 124.806; 90 | 984.1 | Snarskis, G; Pilipavicius, J; Gryaznov, D; Mikoliunaite, L; Vilciauskas, L Peculiarities of Phase Formation in Mn-based NASICON Systems: The Case of Na1+2xMnxTi2-x(PO4)3(0.0<=x<=1.5) Chemistry of Materials, 2021, 33, 8394-8403 |
| 4004056 | CIF | C185 H278 Ag43 K N6 O112 P5 W30 | P -1 | 21.7545; 23.2675; 35.6129 92.351; 98.585; 110.774 | 16579.2 | Zhang, Shan-Shan; Chen, Jing-Yi; Li, Kai; Yuan, Jun-Di; Su, Hai-Feng; Wang, Zhi; Kurmoo, Mohamedally; Li, Ying-Zhou; Gao, Zhi-Yong; Tung, Chen-Ho; Sun, Di; Zheng, Lansun Janus Cluster: Asymmetric Coverage of a Ag43 Cluster on the Symmetric Preyssler P5W30 Polyoxometalate Chemistry of Materials, 2021, 33, 9708-9714 |
| 4004057 | CIF | Ag0.28 Mn0.86 Sb2 Yb2 | P 63 m c | 4.654; 4.654; 7.6686 90; 90; 120 | 143.85 | Liu, Kefeng; Liu, Jian; Liu, Qian; Wang, Qiqi; Yu, Fang; Liu, Xiao-Cun; Xia, Sheng-Qing Phase Transitions, Structure Evolution, and Thermoelectric Properties Based on A2MnSb2 (A = Ca, Yb) Chemistry of Materials, 2021, 33, 9732-9740 |
| 4004058 | CIF | Ag0.58 Ca2 Mn0.71 Sb2 | P 63 m c | 4.6848; 4.6848; 7.7443 90; 90; 120 | 147.2 | Liu, Kefeng; Liu, Jian; Liu, Qian; Wang, Qiqi; Yu, Fang; Liu, Xiao-Cun; Xia, Sheng-Qing Phase Transitions, Structure Evolution, and Thermoelectric Properties Based on A2MnSb2 (A = Ca, Yb) Chemistry of Materials, 2021, 33, 9732-9740 |
| 4004059 | CIF | C40 H64 Cl10 N4 Sb2 | P 1 n 1 | 18.4709; 9.53635; 18.6873 90; 114.223; 90 | 3001.86 | Molokeev, Maxim S.; Su, Binbin; Aleksandrovsky, Aleksandr S.; Golovnev, Nicolay N.; Plyaskin, Mikhail E.; Xia, Zhiguo Machine Learning Analysis and Discovery of Zero-Dimensional ns2 Metal Halides toward Enhanced Photoluminescence Quantum Yield Chemistry of Materials, 2022, 34, 537-546 |
| 4004060 | CIF | C8 H20 Cl5 N2 Sb | P b c a | 11.7848; 11.8754; 23.334 90; 90; 90 | 3265.57 | Molokeev, Maxim S.; Su, Binbin; Aleksandrovsky, Aleksandr S.; Golovnev, Nicolay N.; Plyaskin, Mikhail E.; Xia, Zhiguo Machine Learning Analysis and Discovery of Zero-Dimensional ns2 Metal Halides toward Enhanced Photoluminescence Quantum Yield Chemistry of Materials, 2022, 34, 537-546 |
| 4004061 | CIF | C8 H20 I4 N2 O2 Pb | C 1 2/c 1 | 9.392; 8.6729; 23.2152 90; 94.5715; 90 | 1885 | Li, Zhi; Nega, Philip W.; Nellikkal, Mansoor Ani Najeeb; Dun, Chaochao; Zeller, Matthias; Urban, Jeffrey J.; Saidi, Wissam A.; Schrier, Joshua; Norquist, Alexander J.; Chan, Emory M. Dimensional Control over Metal Halide Perovskite Crystallization Guided by Active Learning Chemistry of Materials, 2022, 34, 756-767 |
| 4004062 | CIF | C4 H10 I3 N O Pb | P 21 21 21 | 8.1767; 8.7039; 16.5225 90; 90; 90 | 1175.89 | Li, Zhi; Nega, Philip W.; Nellikkal, Mansoor Ani Najeeb; Dun, Chaochao; Zeller, Matthias; Urban, Jeffrey J.; Saidi, Wissam A.; Schrier, Joshua; Norquist, Alexander J.; Chan, Emory M. Dimensional Control over Metal Halide Perovskite Crystallization Guided by Active Learning Chemistry of Materials, 2022, 34, 756-767 |
| 4004063 | CIF | C1.14 H1.43 N0.86 | P b c a | 10.906; 5.7031; 15.132 90; 90; 90 | 941.2 | Zhang, Zi-Peng; Liu, Xin; Liu, Xiaomeng; Lu, Zhong-Wei; Sui, Xin; Zhen, Bo-Yu; Lin, Zheshuai; Chen, Ling; Wu, Li-Ming Driving Nonlinear Optical Activity with Dipolar 2-Aminopyrimidinium Cations in (C4H6N3)+(H2PO3)− Chemistry of Materials, 2022, 34, 1976-1984 |
| 4004064 | CIF | C2 H4 N1.5 O1.5 P0.5 | P 1 21 1 | 4.536; 17.4264; 4.7517 90; 95.35; 90 | 373.97 | Zhang, Zi-Peng; Liu, Xin; Liu, Xiaomeng; Lu, Zhong-Wei; Sui, Xin; Zhen, Bo-Yu; Lin, Zheshuai; Chen, Ling; Wu, Li-Ming Driving Nonlinear Optical Activity with Dipolar 2-Aminopyrimidinium Cations in (C4H6N3)+(H2PO3)− Chemistry of Materials, 2022, 34, 1976-1984 |
| 4004065 | CIF | C24 H22 Cd I4 N4 O2 | C 1 c 1 | 20.5433; 9.6018; 15.8277 90; 102.817; 90 | 3044.27 | Lv, Hui-Peng; Xu, Zhe-Kun; Yu, Hang; Huang, Chao-Ran; Wang, Zhong-Xia A Photochromic Organic–Inorganic Hybrid Schiff Base Metal Halide Ferroelectric Chemistry of Materials, 2022, 34, 1737-1745 |
| 4004066 | CIF | C12 H11 Br N2 O | P 1 21/c 1 | 12.4902; 7.3161; 13.3109 90; 106; 90 | 1169.22 | Lv, Hui-Peng; Xu, Zhe-Kun; Yu, Hang; Huang, Chao-Ran; Wang, Zhong-Xia A Photochromic Organic–Inorganic Hybrid Schiff Base Metal Halide Ferroelectric Chemistry of Materials, 2022, 34, 1737-1745 |
| 4004067 | CIF | C12 H11 I N2 O | P 1 21/c 1 | 12.5159; 7.5277; 13.7218 90; 106.358; 90 | 1240.48 | Lv, Hui-Peng; Xu, Zhe-Kun; Yu, Hang; Huang, Chao-Ran; Wang, Zhong-Xia A Photochromic Organic–Inorganic Hybrid Schiff Base Metal Halide Ferroelectric Chemistry of Materials, 2022, 34, 1737-1745 |
| 4004068 | CIF | C24 H22 Br4 Cd N4 O2 | P -1 | 9.2789; 9.3226; 16.7163 97.28; 90.319; 94.783 | 1429.18 | Lv, Hui-Peng; Xu, Zhe-Kun; Yu, Hang; Huang, Chao-Ran; Wang, Zhong-Xia A Photochromic Organic–Inorganic Hybrid Schiff Base Metal Halide Ferroelectric Chemistry of Materials, 2022, 34, 1737-1745 |
| 4004069 | CIF | C6 H9 Br4 N3 Pb | C 1 2/c 1 | 16.3428; 9.061; 18.5386 90; 101.743; 90 | 2687.8 | Ma, Chuang; Gao, Lili; Xu, Zhuo; Li, Xiaotong; Song, Xin; Liu, Yucheng; Yang, Tinghuan; Li, Haojin; Du, Yachao; Zhao, Guangtao; Liu, Xinmei; Kanatzidis, Mercouri G.; Liu, Shengzhong Frank; Zhao, Kui Centimeter-Sized 2D Perovskitoid Single Crystals for Efficient X-ray Photoresponsivity Chemistry of Materials, 2022, 34, 1699-1709 |
| 4004070 | CIF | C6 H9 Cl4 N3 Pb | P -1 | 8.7977; 8.8461; 9.5142 105.05; 96.33; 115.707 | 622.8 | Ma, Chuang; Gao, Lili; Xu, Zhuo; Li, Xiaotong; Song, Xin; Liu, Yucheng; Yang, Tinghuan; Li, Haojin; Du, Yachao; Zhao, Guangtao; Liu, Xinmei; Kanatzidis, Mercouri G.; Liu, Shengzhong Frank; Zhao, Kui Centimeter-Sized 2D Perovskitoid Single Crystals for Efficient X-ray Photoresponsivity Chemistry of Materials, 2022, 34, 1699-1709 |
| 4004071 | CIF | C6 H9 I4 N3 Pb | C 1 2/c 1 | 17.0883; 9.4534; 19.6226 90; 101.866; 90 | 3102.1 | Ma, Chuang; Gao, Lili; Xu, Zhuo; Li, Xiaotong; Song, Xin; Liu, Yucheng; Yang, Tinghuan; Li, Haojin; Du, Yachao; Zhao, Guangtao; Liu, Xinmei; Kanatzidis, Mercouri G.; Liu, Shengzhong Frank; Zhao, Kui Centimeter-Sized 2D Perovskitoid Single Crystals for Efficient X-ray Photoresponsivity Chemistry of Materials, 2022, 34, 1699-1709 |
| 4004072 | CIF | Ga2 Ir3 La | P 6/m m m | 5.5884; 5.5884; 3.9063 90; 90; 120 | 105.65 | Gui, Xin; Cava, Robert J. LaIr3Ga2: A Superconductor Based on a Kagome Lattice of Ir Chemistry of Materials, 2022, 34, 2824-2832 |
| 4004073 | CIF | C19 H29 N5 | P 1 21/c 1 | 16.1515; 6.0242; 20.0589 90; 109.261; 90 | 1842.48 | Huang, Xianhui; Shangguan, Zhichun; Zhang, Zhao-Yang; Yu, Chunyang; He, Yixin; Fang, Dong; Sun, Wenjin; Li, Yan-Chun; Yuan, Chenrui; Wu, Si; Li, Tao Visible-Light-Induced Reversible Photochemical Crystal–Liquid Transitions of Azo-Switches for Smart and Robust Adhesives Chemistry of Materials, 2022, 34, 2636-2644 |
| 4004074 | CIF | C32 H48 Ag Cl8 Fe N4 | C 1 2 1 | 38.6306; 7.3226; 7.2843 90; 90.585; 90 | 2060.45 | Xue, Jie; Wang, Ziyu; Comstock, Andrew; Wang, Zhiyu; Sung, Herman H. Y.; Williams, Ian D.; Sun, Dali; Liu, Junwei; Lu, Haipeng Chemical Control of Magnetic Ordering in Hybrid Fe–Cl Layered Double Perovskites Chemistry of Materials, 2022, 34, 2813-2823 |
| 4004075 | CIF | C36 H56 Ag Cl8 Fe N4 | P 1 21 1 | 7.7313; 35.4619; 7.7347 90; 90.807; 90 | 2120.39 | Xue, Jie; Wang, Ziyu; Comstock, Andrew; Wang, Zhiyu; Sung, Herman H. Y.; Williams, Ian D.; Sun, Dali; Liu, Junwei; Lu, Haipeng Chemical Control of Magnetic Ordering in Hybrid Fe–Cl Layered Double Perovskites Chemistry of Materials, 2022, 34, 2813-2823 |
| 4004076 | CIF | C32 H48 Cl8 Fe N4 Na | P 1 21/c 1 | 7.25334; 39.2496; 7.18736 90; 90.6398; 90 | 2046.05 | Xue, Jie; Wang, Ziyu; Comstock, Andrew; Wang, Zhiyu; Sung, Herman H. Y.; Williams, Ian D.; Sun, Dali; Liu, Junwei; Lu, Haipeng Chemical Control of Magnetic Ordering in Hybrid Fe–Cl Layered Double Perovskites Chemistry of Materials, 2022, 34, 2813-2823 |
| 4004077 | CIF | C8 H28 Ag Cl8 In N4 | P -1 | 7.7161; 7.8117; 9.3428 102.735; 91.155; 90.898 | 549.06 | Xue, Jie; Wang, Ziyu; Comstock, Andrew; Wang, Zhiyu; Sung, Herman H. Y.; Williams, Ian D.; Sun, Dali; Liu, Junwei; Lu, Haipeng Chemical Control of Magnetic Ordering in Hybrid Fe–Cl Layered Double Perovskites Chemistry of Materials, 2022, 34, 2813-2823 |
| 4004078 | CIF | C8 H28 Ag Cl8 Fe N4 | P -1 | 7.5923; 10.8224; 13.3237 76.162; 89.632; 89.618 | 1062.96 | Xue, Jie; Wang, Ziyu; Comstock, Andrew; Wang, Zhiyu; Sung, Herman H. Y.; Williams, Ian D.; Sun, Dali; Liu, Junwei; Lu, Haipeng Chemical Control of Magnetic Ordering in Hybrid Fe–Cl Layered Double Perovskites Chemistry of Materials, 2022, 34, 2813-2823 |
| 4004079 | CIF | Al3 K Na2 O12 Si3 | P -1 | 7.94578; 5.1687; 15.1654 89.848; 93.6133; 89.9481 | 621.593 | Asselman, K.; Radhakrishnan, S.; Pellens, N.; Vinod Chandran, C.; Houlleberghs, M.; Xu, Y.; Martens, J. A.; Breynaert, E. HSIL-Based Synthesis of Ultracrystalline K,Na-JBW, a Zeolite Exhibiting Exceptional Framework Ordering and Flexibility Chemistry of Materials, 2022, 34, 7159 |
| 4004080 | CIF | Al3 K Na2 O12 Si3 | P m n 21 | 15.1422; 8.125613; 5.176215 90; 90; 90 | 636.88 | Asselman, K.; Radhakrishnan, S.; Pellens, N.; Vinod Chandran, C.; Houlleberghs, M.; Xu, Y.; Martens, J. A.; Breynaert, E. HSIL-Based Synthesis of Ultracrystalline K,Na-JBW, a Zeolite Exhibiting Exceptional Framework Ordering and Flexibility Chemistry of Materials, 2022, 34, 7159 |
| 4004081 | CIF | Cs Gd S2 | R -3 m :H | 4.11724; 4.11724; 24.0408 90; 90; 120 | 352.933 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004082 | CIF | Cs Gd S2 | P 63/m m c | 4.11494; 4.11494; 16.0144 90; 90; 120 | 234.838 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004083 | CIF | Gd2 O2 S | P -3 m 1 | 3.8535; 3.8535; 6.6663 90; 90; 120 | 85.729 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004084 | CIF | Gd2 O3 | I a -3 | 10.8113; 10.8113; 10.8113 90; 90; 90 | 1263.67 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004085 | CIF | Gd2 S3 | P n m a | 7.3424; 3.93196; 15.2841 90; 90; 90 | 441.25 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004086 | CIF | Gd10 S19 | P 42/n :2 | 8.7147; 8.7147; 15.8569 90; 90; 90 | 1204.27 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004087 | CIF | Gd K S2 | R -3 m :H | 4.07711; 4.07711; 21.917 90; 90; 120 | 315.513 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004088 | CIF | Gd Li S2 | F m -3 m | 5.52988; 5.52988; 5.52988 90; 90; 90 | 169.101 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004089 | CIF | Gd Na S2 | R -3 m :H | 4.01349; 4.01349; 19.9189 90; 90; 120 | 277.869 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004090 | CIF | Gd Rb S2 | R -3 m :H | 4.09729; 4.09729; 22.874 90; 90; 120 | 332.557 | Delacotte, C.; Pomelova, T.A.; Stephant, T.; Guizouarn, T.; Cordier, S.; Naumov, N.G.; Lemoine, P. 'NaGdS2: a promising sulfide for cryogenic magnetic cooling' Chemistry of Materials, 2022, 34, 1829-1837 |
| 4004091 | CIF | Eu2 O7 Si2 | P n m a | 13.9144; 8.3502; 5.0557 90; 90; 90 | 587.41 | Chen, Pengyun; Zhou, Yuqiao; He, Jin; Jiang, Wei; Li, Junhao; Ni, Haiyong; Zhang, Qiuhong; Lin, Litian On the Crystal Chemistry of RE2Si2O7: Revisited Structures, Group–Subgroup Relationship, and Insights of Ce3±Activated Radioluminescence Chemistry of Materials, 2023, 35, 2635-2646 |
| 4004092 | CIF | Gd2 O7 Si2 | P n m a | 13.85; 8.291; 5.0507 90; 90; 90 | 580 | Chen, Pengyun; Zhou, Yuqiao; He, Jin; Jiang, Wei; Li, Junhao; Ni, Haiyong; Zhang, Qiuhong; Lin, Litian On the Crystal Chemistry of RE2Si2O7: Revisited Structures, Group–Subgroup Relationship, and Insights of Ce3±Activated Radioluminescence Chemistry of Materials, 2023, 35, 2635-2646 |
| 4004093 | CIF | O7 Si2 Tb2 | P n m a | 13.817; 8.244; 5.0348 90; 90; 90 | 573.5 | Chen, Pengyun; Zhou, Yuqiao; He, Jin; Jiang, Wei; Li, Junhao; Ni, Haiyong; Zhang, Qiuhong; Lin, Litian On the Crystal Chemistry of RE2Si2O7: Revisited Structures, Group–Subgroup Relationship, and Insights of Ce3±Activated Radioluminescence Chemistry of Materials, 2023, 35, 2635-2646 |
| 4004094 | CIF | Dy2 O7 Si2 | P n m a | 13.725; 8.2019; 5.03 90; 90; 90 | 566.23 | Chen, Pengyun; Zhou, Yuqiao; He, Jin; Jiang, Wei; Li, Junhao; Ni, Haiyong; Zhang, Qiuhong; Lin, Litian On the Crystal Chemistry of RE2Si2O7: Revisited Structures, Group–Subgroup Relationship, and Insights of Ce3±Activated Radioluminescence Chemistry of Materials, 2023, 35, 2635-2646 |
| 4004095 | CIF | Ho2 O7 Si2 | P n m a | 13.6575; 8.1544; 5.0191 90; 90; 90 | 558.97 | Chen, Pengyun; Zhou, Yuqiao; He, Jin; Jiang, Wei; Li, Junhao; Ni, Haiyong; Zhang, Qiuhong; Lin, Litian On the Crystal Chemistry of RE2Si2O7: Revisited Structures, Group–Subgroup Relationship, and Insights of Ce3±Activated Radioluminescence Chemistry of Materials, 2023, 35, 2635-2646 |
| 4004096 | CIF | Eu2 O7 Si2 | P -1 | 5.3877; 8.5212; 12.8536 90.422; 91.616; 92.247 | 589.4 | Chen, Pengyun; Zhou, Yuqiao; He, Jin; Jiang, Wei; Li, Junhao; Ni, Haiyong; Zhang, Qiuhong; Lin, Litian On the Crystal Chemistry of RE2Si2O7: Revisited Structures, Group–Subgroup Relationship, and Insights of Ce3±Activated Radioluminescence Chemistry of Materials, 2023, 35, 2635-2646 |
| 4004097 | CIF | O7 Si2 Sm2 | P -1 | 5.381; 8.537; 12.855 90.173; 90.746; 91.451 | 590.29 | Chen, Pengyun; Zhou, Yuqiao; He, Jin; Jiang, Wei; Li, Junhao; Ni, Haiyong; Zhang, Qiuhong; Lin, Litian On the Crystal Chemistry of RE2Si2O7: Revisited Structures, Group–Subgroup Relationship, and Insights of Ce3±Activated Radioluminescence Chemistry of Materials, 2023, 35, 2635-2646 |
| 4004098 | CIF | La2 O7 Si2 | P 1 21/n 1 | 5.4134; 8.799; 13.1858 90; 90.515; 90 | 628.05 | Chen, Pengyun; Zhou, Yuqiao; He, Jin; Jiang, Wei; Li, Junhao; Ni, Haiyong; Zhang, Qiuhong; Lin, Litian On the Crystal Chemistry of RE2Si2O7: Revisited Structures, Group–Subgroup Relationship, and Insights of Ce3±Activated Radioluminescence Chemistry of Materials, 2023, 35, 2635-2646 |
| 5000177 | CIF | C6 H5 N O3 | P 1 21/c 1 | 6.1664; 8.8366; 11.5435 90; 103.39; 90 | 611.91 | Kulkarni, G. U.; Kumaradhas, P.; Rao, C. N. R. Charge Density Study of the Polymorphs of p-Nitrophenol Chemistry of Materials, 1998, 10, 3498-3505 |
| 6000035 | CIF | Cs2 O15 Si6 Ti | C 1 c 1 | 12.998; 7.5014; 15.156 90; 105.8; 90 | 1420.8 | Nyman, M.; Bonhomme, F.; Teter, D. M.; Maxwell, R. S.; Gu, B. X.; Wang, L. M.; Ewing, R. C.; Nenoff, T. M. Integrated experimental and computational methods for structure determination and characterization of a new, highly stable cesium silicotitanate phase, Cs~2~TiSi~6~O~15~ (SNL-A) Chemistry of Materials, 2000, 12, 3449-3458 |
| 6000060 | CIF | C8 H6 Co2 O6 | C 1 2/m 1 | 19.943; 3.2895; 6.2896 90; 95.746; 90 | 410.54 | Huang, Z. L.; Drillon, M.; Masciocchi, N.; Sironi, A.; Zhao, J. T.; Rabu, P.; Panissod, P. Ab-initio xrpd crystal structure and giant hysteretic effect (H-c=5.9 T) of a new hybrid terephthalate-based cobalt(II) magnet Chemistry of Materials, 2000, 12, 2805-2812 |
| 6000074 | CIF | C8 H12 O22 Pb2 Zr | C 1 2/c 1 | 9.537; 29.622; 8.9398 90; 121.19; 90 | 2160.5 | Boudaren, C.; Auffrédic, J. P.; Louër, M.; Louër, D. Synthesis, structure determination from powder diffraction data, and thermal behavior of lead zirconium oaxalate hydrate Pb2Zr(C2O4)(4)center dot nH(2)O (3 < n < 9) Chemistry of Materials, 2000, 12, 2324-2333 |
| 6000102 | CIF | H25 Na O51 Si12 Sr4 Ti5 | C m m m | 23.1962; 7.2381; 6.9652 90; 90; 90 | 1169.43 | Braunbarth, C.; Hillhouse, H. W.; Tsapatsis, M.; Burton, A.; Lobo, R. F.; Jacubinas, R. M.; Kuznicki, S. M. Structure of strontium ion-exchanged ETS-4 microporous molecular sieves Chemistry of Materials, 2000, 12, 1857-1865 |
| 6000112 | CIF | Ga10 H38 O83 Si22 Sr5 | P n m a | 8.6826; 13.8828; 16.2484 90; 90; 90 | 1958.56 | Lee, Y. J.; Kim, S. J.; Schoonen, M. A. A.; Parise, J. B. Structural and Sr2+ ion exchange studies of gallosilicate TsG-1 Chemistry of Materials, 2000, 12, 1597-1603 |
| 6000286 | CIF | Ba5 Cu Ir3 O12 | P3c& | 10.1405; 10.1496; 21.6599 90; 90; 90 | 2229.28 | Blake, G. R.; Battle, P. D.; Sloan, J.; Vente, J. F.; Darriet, J.; Weill, F. Neutron diffraction study of the structures of Ba5CuIr3O12 and Ba16Cu3Ir10O39 Chemistry of Materials, 1999, 11, 1551-1558 |
| 6000287 | CIF | Ba16 Cu3 Ir10 O39 | P 3 2 1 | 10.1344; 10.1344; 35.0564 90; 90; 120 | 3118.14 | Blake, G. R.; Battle, P. D.; Sloan, J.; Vente, J. F.; Darriet, J.; Weill, F. Neutron diffraction study of the structures of Ba5CuIr3O12 and Ba16Cu3Ir10O39 Chemistry of Materials, 1999, 11, 1551-1558 |
| 6000288 | CIF | C4 H8 K O12 Y | I 41/a :2 | 11.4612; 11.4612; 8.904 90; 90; 90 | 1169.62 | Bataille, T.; Auffredic, J. P.; Louer, D. Ab initio structure determination and dehydration dynamics of YK(C2O4)(2).4H(2)O studied by X-ray powder diffraction Chemistry of Materials, 1999, 11, 1559-1567 |
| 6000318 | CIF | Ca4 Fe Mn2 O9.75 | I 4/m m m | 3.7368; 3.7368; 27.086 90; 90; 90 | 378.23 | Battle, P. D.; Branford, W. R.; Mihut, A.; Rosseinsky, M. J.; Singleton, J.; Sloan, J.; Spring, L. E.; Vente, J. F. Structural chemistry and electronic properties of the n=3 Ruddlesden-Popper phases Ca4Mn2FeO9.75 and Sr4Mn2FeO9.80 Chemistry of Materials, 1999, 11, 674-683 |
| 6000319 | CIF | Fe Mn2 O9.8 Sr4 | I 4/m m m | 3.8339; 3.8339; 27.8148 90; 90; 90 | 408.85 | Battle, P. D.; Branford, W. R.; Mihut, A.; Rosseinsky, M. J.; Singleton, J.; Sloan, J.; Spring, L. E.; Vente, J. F. Structural chemistry and electronic properties of the n=3 Ruddlesden-Popper phases Ca4Mn2FeO9.75 and Sr4Mn2FeO9.80 Chemistry of Materials, 1999, 11, 674-683 |
| 6000320 | CIF | Co La2 O10 Ti3 | I 4/m m m | 3.8128; 3.8128; 27.568 90; 90; 90 | 402.6 | Hyeon, K. A.; Byeon, S. H. Synthesis and structure of new layered oxides, (MLa2Ti3O10)-La-II (M = Co, Cu, and Zn) Chemistry of Materials, 1999, 11, 352-357 |
| 6000321 | CIF | Cu La2 O10 Ti3 | I 4/m m m | 3.8248; 3.8248; 26.329 90; 90; 90 | 385.17 | Hyeon, K. A.; Byeon, S. H. Synthesis and structure of new layered oxides, (MLa2Ti3O10)-La-II (M = Co, Cu, and Zn) Chemistry of Materials, 1999, 11, 352-357 |
| 6000322 | CIF | La2 O10 Ti3 Zn | I 4/m m m | 3.8127; 3.8127; 27.5129 90; 90; 90 | 399.95 | Hyeon, K. A.; Byeon, S. H. Synthesis and structure of new layered oxides, (MLa2Ti3O10)-La-II (M = Co, Cu, and Zn) Chemistry of Materials, 1999, 11, 352-357 |
| 6000323 | CIF | C3 H8 O6 P2 Zn | P 1 21/n 1 | 18.167; 5.085; 8.658 90; 93.63; 90 | 798.21 | Poojary, D. M.; Zhang, B. L.; Clearfield, A. Syntheses and X-ray powder structures of two zinc propylenebis(phosphonates) Chemistry of Materials, 1999, 11, 421-426 |
| 6000324 | CIF | C6 H18 O14 P4 Zn3 | C 1 2/c 1 | 20.5853; 5.0472; 18.014 90; 97.226; 90 | 1856.76 | Poojary, D. M.; Zhang, B. L.; Clearfield, A. Syntheses and X-ray powder structures of two zinc propylenebis(phosphonates) Chemistry of Materials, 1999, 11, 421-426 |
| 6000346 | CIF | Ag2 Bi O6 Ti2 | I b a m | 5.4897; 5.5195; 7.1758 90; 90; 90 | 217.43 | Park, J. H.; Woodward, P. M.; Parise, J. B.; Reeder, R. J.; Lubomirsky, I.; Stafsudd, O. Synthesis, structure, and dielectric properties of (Bi1/2Ag1/2)TiO3 Chemistry of Materials, 1999, 11, 177-183 |
| 6000347 | CIF | Ag2 Bi O6 Ti2 | I 4/m c m | 5.5166; 5.5166; 7.8134 90; 90; 90 | 237.79 | Park, J. H.; Woodward, P. M.; Parise, J. B.; Reeder, R. J.; Lubomirsky, I.; Stafsudd, O. Synthesis, structure, and dielectric properties of (Bi1/2Ag1/2)TiO3 Chemistry of Materials, 1999, 11, 177-183 |
| 6000348 | CIF | Ag2 Bi O6 Ti2 | P m -3 m | 3.9061; 3.9061; 3.9061 90; 90; 90 | 59.6 | Park, J. H.; Woodward, P. M.; Parise, J. B.; Reeder, R. J.; Lubomirsky, I.; Stafsudd, O. Synthesis, structure, and dielectric properties of (Bi1/2Ag1/2)TiO3 Chemistry of Materials, 1999, 11, 177-183 |
| 6000394 | CIF | B2 Ir5 Sc3 | P 4/m b m | 9.526; 9.526; 3.048 90; 90; 90 | 276.59 | Nagelschmitz, E. A.; Jung, W. Scandium iridium boride Sc3Ir5B2 and the quaternary derivatives Sc2MIr5B2 with m = Be, Al, Si, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Ga, or Ge: Preparation, crystal structure, and physical properties Chemistry of Materials, 1998, 10, 3189-3195 |
| 6000395 | CIF | B2 Be Ir5 Sc2 | P 4/m b m | 9.27; 9.27; 2.968 90; 90; 90 | 255.05 | Nagelschmitz, E. A.; Jung, W. Scandium iridium boride Sc3Ir5B2 and the quaternary derivatives Sc2MIr5B2 with m = Be, Al, Si, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Ga, or Ge: Preparation, crystal structure, and physical properties Chemistry of Materials, 1998, 10, 3189-3195 |
| 6000396 | CIF | B2 Ir5 Sc2 Ti | P 4/m b m | 9.329; 9.329; 3.103 90; 90; 90 | 270.05 | Nagelschmitz, E. A.; Jung, W. Scandium iridium boride Sc3Ir5B2 and the quaternary derivatives Sc2MIr5B2 with m = Be, Al, Si, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Ga, or Ge: Preparation, crystal structure, and physical properties Chemistry of Materials, 1998, 10, 3189-3195 |
| 6000397 | CIF | H5 Ho O10 S2 | I 41/a m d | 6.914; 6.914; 17.246 90; 90; 90 | 824.42 | Wickleder, M. S. Synthesis, crystal structure, and thermal behavior of the rare earth sulfates (H5O2)M(SO4)(2) (M = Ho, Er, Y) Chemistry of Materials, 1998, 10, 3212-3216 |
| 6000398 | CIF | Er H5 O10 S2 | I 41/a m d | 6.8967; 6.8967; 17.166 90; 90; 90 | 816.49 | Wickleder, M. S. Synthesis, crystal structure, and thermal behavior of the rare earth sulfates (H5O2)M(SO4)(2) (M = Ho, Er, Y) Chemistry of Materials, 1998, 10, 3212-3216 |
| 6000399 | CIF | H5 O10 S2 Y | I 41/a m d | 6.8875; 6.8875; 17.159 90; 90; 90 | 813.98 | Wickleder, M. S. Synthesis, crystal structure, and thermal behavior of the rare earth sulfates (H5O2)M(SO4)(2) (M = Ho, Er, Y) Chemistry of Materials, 1998, 10, 3212-3216 |
| 6000410 | CIF | C4 Co N6 | P n n m | 5.9985; 7.0711; 7.414 90; 90; 90 | 314.47 | Manson, J. L.; Kmety, C. R.; Huang, Q. Z.; Lynn, J. W.; Bendele, G. M.; Pagola, S.; Stephens, P. W.; Liable-Sands, L. M.; Rheingold, A. L.; Epstein, A. J.; Miller, J. S. Structure and magnetic ordering of M-II[N(CN)(2)](2) (M = Co, Ni) Chemistry of Materials, 1998, 10, 2552-2560 |
| 6000411 | CIF | C4 N6 Ni | P n n m | 5.9736; 7.032; 7.2942 90; 90; 90 | 306.4 | Manson, J. L.; Kmety, C. R.; Huang, Q. Z.; Lynn, J. W.; Bendele, G. M.; Pagola, S.; Stephens, P. W.; Liable-Sands, L. M.; Rheingold, A. L.; Epstein, A. J.; Miller, J. S. Structure and magnetic ordering of M-II[N(CN)(2)](2) (M = Co, Ni) Chemistry of Materials, 1998, 10, 2552-2560 |
| 6000469 | CIF | C7 H6 K8 N O11 Y | P -1 | 8.229; 9.739; 9.754 60.74; 72.36; 84.67 | 648.47 | Vaidhyanathan, R.; Natarajan, S.; Rao, C. N. R. Three-dimensional yttrium oxalates possessing large channels Chemistry of Materials, 2001, 13, 185-191 |
| 6000470 | CIF | C9 H12 N2 O8 Y | C 1 c 1 | 11.552; 17.168; 8.719 90; 130.64; 90 | 1312.14 | Vaidhyanathan, R.; Natarajan, S.; Rao, C. N. R. Three-dimensional yttrium oxalates possessing large channels Chemistry of Materials, 2001, 13, 185-191 |
| 6000505 | CIF | C3 H14 F Ga N2 O8 P2 | P b c m | 8.642; 19.346; 7.114 90; 90; 90 | 1189.38 | Walton, R. I.; Millange, F.; O'hare, D.; Paulet, C.; Loiseau, T.; Ferey, G. Synthesis, structures, and reactivity of two compounds containing the tancoite-like [Ga(HPO4)(2)F](2-)(infinity) chain Chemistry of Materials, 2000, 12, 1977-1984 |
| 6000516 | CIF | F Ga H4 N O4 P | P n a 21 | 12.9207; 6.44; 10.4147 90; 90; 90 | 866.6 | Loiseau, T.; Paulet, C.; Simon, N.; Munch, V.; Taulelle, F.; Ferey, G. Hydrothermal synthesis and structural characterization of (NH4)GaPO4F, KTP-type and (NH4)(2)Ga-2(PO4) (HPO4)F-3, pseudo-KTP-type Chemistry of Materials, 2000, 12, 1393-1399 |
| 6000517 | CIF | F3 Ga2 H9 N2 O8 P2 | P n a 21 | 12.4967; 7.7015; 9.8463 90; 90; 90 | 947.64 | Loiseau, T.; Paulet, C.; Simon, N.; Munch, V.; Taulelle, F.; Ferey, G. Hydrothermal synthesis and structural characterization of (NH4)GaPO4F, KTP-type and (NH4)(2)Ga-2(PO4) (HPO4)F-3, pseudo-KTP-type Chemistry of Materials, 2000, 12, 1393-1399 |
| 6000610 | CIF | Bi Ca3 O22 Sr8 | P 1 21/c 1 | 11.037; 5.971; 19.703 90; 101.46; 90 | 1272.58 | Luhrs, C. C.; Molins, E.; Van, Tendeloo G; Beltran-Porter, D.; Fuertes, A. Crystal structure of Bi6Sr8-xCa3+xO22 (-0.5 <= x <= 1.7): a mixed valence bismuth oxide related to perovskite Chemistry of Materials, 1998, 10, 1875-1881 |
| 6000662 | CIF | O10 P2 U2 | P -1 | 8.8212; 9.2173; 5.4772 102.622; 97.748; 102.459 | 416.53 | Benard, P.; Louer, D.; Dacheux, N.; Brandel, V.; Genet, M. U(UO2)((PO4)2, a new mixed-valence uranium orthophosphate - ab-initio structure determination from powder diffraction data and optical and X-RAY photoelectro spectra Chemistry of Materials, 1994, 6, 1049-1058 |
| 6000663 | CIF | C16 H48 Ge4 N4 S10 | P43-n | 19.549; 19.549; 19.549 90; 90; 90 | 7470.91 | Pivan, J. Y.; Achak, O.; Louer, M.; Louer, D. The novel thiogermanate [(CH3)4N]4GE4S10 with a high cubic cell-volume - ab-initio structure determination from conventional X-ray-powder diffraction Chemistry of Materials, 1994, 6, 827-830 |
| 6000667 | CIF | O23 P6 Th4 | P c a m | 12.8646; 10.4374; 7.0676 90; 90; 90 | 948.99 | Benard, P.; Brandel, V.; Dacheux, N.; Jaulmes, S.; Launay, S.; Lindecker, C.; Genet, M.; Louer, D.; Quarton, M. Th-4(PO4)(4)P2O7, a new thorium phosphate: Synthesis, characterization, and structure determination Chemistry of Materials, 1996, 8, 181-188 |
| 6000683 | CIF | Bi17 O33 V3 | 12.27; 12.27; 11.04 90; 90; 90 | 1662.1 | Pang, G. S.; Feng, S. H.; Tang, Y. C.; Tan, C. H.; Xu, R. R. Hydrothermal synthesis, characterization, and ionic conductivity of vanadium-stabilized Bi~17~V~3~O~33~ with fluorite-related superlattice structure Chemistry of Materials, 1998, 10, 2446-2449 | |
| 6000735 | CIF | K O12 P3 U2 | C 1 2/c 1 | 17.4705; 6.7541; 8.0252 90; 102.019; 90 | 926.2 | Hawkins, H. T.; Spearing, D. R.; Veirs, D. K.; Danis, J. A.; Smith, D. M.; Tait, C. D.; Runde, W. H.; Spilde, M. N.; Scheetz, B. E. Synthesis and characterization of uranium(IV)-bearing members of the [NZP] structural family Chemistry of Materials, 1999, 11, 2851-2857 |
| 9012813 | CIF | Al Ge H4 K0.9 Na0.1 O5.666 | C 1 2/c 1 | 14.42; 9.87; 23.33 90; 105.92; 90 | 3193.1 | Celestian, A. J.; Parise, J. B.; Goodell, C.; Tripathi, A.; Hanson, J. Time-resolved diffraction studies of ion exchange: K(+) and Na(+) exchange into (Al,Ge) gismondine (GIS)Na24Al24Ge24O96*40(H2O) and K8Al8Ge8O32*8(H2O) Chemistry of Materials, 2004, 16, 2244-2254 |
| 9012923 | CIF | C5 H18 N4 O21 P4 Sc3 | P 1 21/n 1 | 8.603; 15.476; 16.504 90; 96.877; 90 | 2181.53 | Bull, I.; Young, V.; Teat, S. J.; Peng, L.; Grey, C. P.; Parise, J. B. Hydrothermal synthesis and structural characterization of four scandium phosphate frameworks Chemistry of Materials, 2003, 15, 3818-3825 |
| 9014369 | CIF | Na11 O14 Si4 Ti4 | P 42/m b c | 10.6772; 10.6772; 11.885 90; 90; 90 | 1354.92 | Thorogood, G. J.; Kennedy, B. J.; Griffith, C. S.; Elcombe, M. E.; Avdeev, M.; Hanna, J. V.; Thorogood, S. K.; Luca, V. Structure and phase transformations in the titanosilicate, sitinakite. The importance of water Note: T = 573 K dehydrated sample Chemistry of Materials, 2010, 22, 4222-4231 |
| 9014483 | CIF | Na Nb O3 | P b m a | 5.5625; 15.5495; 5.5138 90; 90; 90 | 476.911 | Xu, H.; Su, Y.; Balmer, M. L.; Navrotsky, A. A new series of oxygen-deficient perovskites in the NaTixNb1-xO3-.05x system: synthesis, crystal chemistry, and energetics Note: x = 0.00 Chemistry of Materials, 2003, 15, 1872-1878 |
| 9014531 | CIF | Na Nb0.9 O2.95 Ti0.1 | P b m a | 5.5428; 15.5632; 5.5094 90; 90; 90 | 475.261 | Xu, H.; Su, Y.; Balmer, M. L.; Navrotsky, A. A new series of oxygen-deficient perovskites in the NaTixNb1-xO3-.05x system: synthesis, crystal chemistry, and energetics Note: x = 0.1 Chemistry of Materials, 2003, 15, 1872-1878 |
| 9014797 | CIF | Co4 In0.2 Sb12 | I m -3 | 9.05294; 9.05294; 9.05294 90; 90; 90 | 741.94 | He, T.; Chen, J.; Rosenfeld, H. D.; Subramanian, M. A. Thermoelectric properties of indium-filled skutterudites Chemistry of Materials, 2006, 18, 759-762 |
| 9015148 | CIF | Na Nb0.85 O2.925 Ti0.15 | P b m a | 5.5396; 15.5705; 5.5087 90; 90; 90 | 475.149 | Xu, H.; Su, Y.; Balmer, M. L.; Navrotsky, A. A new series of oxygen-deficient perovskites in the NaTixNb1-xO3-.05x system: synthesis, crystal chemistry, and energetics Note: x = 0.15 Chemistry of Materials, 2003, 15, 1872-1878 |
| 9015824 | CIF | Na Nb0.8 O2.9 Ti0.2 | P b m a | 5.5303; 15.5677; 5.5072 90; 90; 90 | 474.137 | Xu, H.; Su, Y.; Balmer, M. L.; Navrotsky, A. A new series of oxygen-deficient perovskites in the NaTixNb1-xO3-.05x system: synthesis, crystal chemistry, and energetics Note: x = 0.2 Chemistry of Materials, 2003, 15, 1872-1878 |
| 9016099 | CIF | D4 Na3 O10 Si Ti2 | P 42/m c m | 7.8099; 7.8099; 11.956 90; 90; 90 | 729.251 | Thorogood, G. J.; Kennedy, B. J.; Griffith, C. S.; Elcombe, M. E.; Avdeev, M.; Hanna, J. V.; Thorogood, S. K.; Luca, V. Structure and phase transformations in the titanosilicate, sitinakite. The importance of water Note: T = 298 K with neutron Chemistry of Materials, 2010, 22, 4222-4231 |
| 9016155 | CIF | D4 Na O9 Si Ti2 | P 42/m c m | 7.88; 7.88; 11.953 90; 90; 90 | 742.214 | Thorogood, G. J.; Kennedy, B. J.; Griffith, C. S.; Elcombe, M. E.; Avdeev, M.; Hanna, J. V.; Thorogood, S. K.; Luca, V. Structure and phase transformations in the titanosilicate, sitinakite. The importance of water Note: T = 20 K with neutron Chemistry of Materials, 2010, 22, 4222-4231 |
| 9016224 | CIF | Na Nb0.95 O2.975 Ti0.05 | P b m a | 5.5528; 15.5597; 5.514 90; 90; 90 | 476.409 | Xu, H.; Su, Y.; Balmer, M. L.; Navrotsky, A. A new series of oxygen-deficient perovskites in the NaTixNb1-xO3-.05x system: synthesis, crystal chemistry, and energetics Note: x = 0.05 Chemistry of Materials, 2003, 15, 1872-1878 |
| 9017400 | CIF | Ca2 O9 S2 | P 31 | 6.93145; 6.93145; 12.73617 90; 90; 120 | 529.929 | Christensen, A.; Olesen, M.; Cerenius, Y.; Jensen, T. Formation and transformation of five different phases in the CaSO4-H2O system: crystal structure of the subhydrate beta-CaSO4*0.5H2O and soluble anhydrite CaSO4 Chemistry of Materials, 2008, 20, 2124-2132 |
| 9017401 | CIF | Ca O4 S | P 62 2 2 | 6.96895; 6.96865; 6.30044 90; 90; 120 | 264.983 | Christensen, A.; Olesen, M.; Cerenius, Y.; Jensen, T. Formation and transformation of five different phases in the CaSO4-H2O system: crystal structure of the subhydrate beta-CaSO4*0.5H2O and soluble anhydrite CaSO4 Chemistry of Materials, 2008, 20, 2124-2132 |
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