Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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7247726 | CIF | C17 H15 F N2 O2 | P -1 | 8.8203; 9.1068; 10.6468 67.05; 88.22; 71.172 | 740.95 | Pan, Dongping; Liu, Fu-Xiaomin; Zeng, Zhongyi; Ye, Junwei; Cai, Ying; Wang, Shengdong; Zhou, Zhi; Yi, Wei Practical conversion of gem-difluorocyclopropenes for the chemodivergent assembly of fluorinated heterocyclic frameworks Green Chemistry, 2023, 25, 10630-10637 |
7247727 | CIF | C17 H16 F2 N2 O | F d d 2 | 37.7194; 16.9142; 9.49011 90; 90; 90 | 6054.63 | Pan, Dongping; Liu, Fu-Xiaomin; Zeng, Zhongyi; Ye, Junwei; Cai, Ying; Wang, Shengdong; Zhou, Zhi; Yi, Wei Practical conversion of gem-difluorocyclopropenes for the chemodivergent assembly of fluorinated heterocyclic frameworks Green Chemistry, 2023, 25, 10630-10637 |
7247728 | CIF | C24 H21 F N2 O3 S | P 1 21/c 1 | 11.0253; 19.0234; 11.08 90; 117.375; 90 | 2063.7 | Pan, Dongping; Liu, Fu-Xiaomin; Zeng, Zhongyi; Ye, Junwei; Cai, Ying; Wang, Shengdong; Zhou, Zhi; Yi, Wei Practical conversion of gem-difluorocyclopropenes for the chemodivergent assembly of fluorinated heterocyclic frameworks Green Chemistry, 2023, 25, 10630-10637 |
7247730 | CIF | C48 H48 Co2 N4 O16 | P 21 21 21 | 12.994; 18.489; 20.221 90; 90; 90 | 4858 | Uvarova, Marina A.; Lutsenko, Irina A.; Babeshkin, Konstantin A.; Sokolov, Andrey V.; Alexandrov, Eugeny V.; Efimov, Nikolay N.; Shmelev, Maxim A.; Khoroshilov, Andrey V.; Eremenko, Igor L.; Kiskin, Mikhail A. Solvent effect in the chemical design of coordination polymers of various topologies with Co2+ and Ni2+ ions and 2-furoate anions CrystEngComm, 2023, 25, 6786-6795 |
7247731 | CIF | C34 H26 Co N4 O6 | P c c n | 10.3085; 16.7006; 18.9218 90; 90; 90 | 3257.5 | Uvarova, Marina A.; Lutsenko, Irina A.; Babeshkin, Konstantin A.; Sokolov, Andrey V.; Alexandrov, Eugeny V.; Efimov, Nikolay N.; Shmelev, Maxim A.; Khoroshilov, Andrey V.; Eremenko, Igor L.; Kiskin, Mikhail A. Solvent effect in the chemical design of coordination polymers of various topologies with Co2+ and Ni2+ ions and 2-furoate anions CrystEngComm, 2023, 25, 6786-6795 |
7247732 | CIF | C28 H23 N3 Ni O7 | R -3 :H | 26.789; 26.789; 25.456 90; 90; 120 | 15821 | Uvarova, Marina A.; Lutsenko, Irina A.; Babeshkin, Konstantin A.; Sokolov, Andrey V.; Alexandrov, Eugeny V.; Efimov, Nikolay N.; Shmelev, Maxim A.; Khoroshilov, Andrey V.; Eremenko, Igor L.; Kiskin, Mikhail A. Solvent effect in the chemical design of coordination polymers of various topologies with Co2+ and Ni2+ ions and 2-furoate anions CrystEngComm, 2023, 25, 6786-6795 |
7247733 | CIF | C70 H55 N9 Ni2 O12 | P c c n | 10.4988; 16.7826; 18.4931 90; 90; 90 | 3258.43 | Uvarova, Marina A.; Lutsenko, Irina A.; Babeshkin, Konstantin A.; Sokolov, Andrey V.; Alexandrov, Eugeny V.; Efimov, Nikolay N.; Shmelev, Maxim A.; Khoroshilov, Andrey V.; Eremenko, Igor L.; Kiskin, Mikhail A. Solvent effect in the chemical design of coordination polymers of various topologies with Co2+ and Ni2+ ions and 2-furoate anions CrystEngComm, 2023, 25, 6786-6795 |
7247734 | CIF | C8 H4 N4 O2 | P 1 21/c 1 | 7.74397; 5.37413; 18.739 90; 99.3886; 90 | 769.42 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Fedyanin, Ivan V. What are the prospects of [1,2,5]oxadiazolo[3,4-c]cinnoline 5-oxides, 1,5-dioxides and their nitro derivatives as high-energy-density materials? Synthesis, experimental and predicted crystal structures, and calculated explosive properties CrystEngComm, 2023, 25, 6719-6739 |
7247735 | CIF | C8 H3 N5 O4 | P n a 21 | 14.2846; 9.9978; 6.3863 90; 90; 90 | 912.06 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Fedyanin, Ivan V. What are the prospects of [1,2,5]oxadiazolo[3,4-c]cinnoline 5-oxides, 1,5-dioxides and their nitro derivatives as high-energy-density materials? Synthesis, experimental and predicted crystal structures, and calculated explosive properties CrystEngComm, 2023, 25, 6719-6739 |
7247736 | CIF | C8 H3 N5 O4 | P b c a | 8.6598; 12.7026; 15.575 90; 90; 90 | 1713.28 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Fedyanin, Ivan V. What are the prospects of [1,2,5]oxadiazolo[3,4-c]cinnoline 5-oxides, 1,5-dioxides and their nitro derivatives as high-energy-density materials? Synthesis, experimental and predicted crystal structures, and calculated explosive properties CrystEngComm, 2023, 25, 6719-6739 |
7247737 | CIF | C8 H3 N5 O5 | P n a 21 | 14.40027; 10.46252; 6.13809 90; 90; 90 | 924.784 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Fedyanin, Ivan V. What are the prospects of [1,2,5]oxadiazolo[3,4-c]cinnoline 5-oxides, 1,5-dioxides and their nitro derivatives as high-energy-density materials? Synthesis, experimental and predicted crystal structures, and calculated explosive properties CrystEngComm, 2023, 25, 6719-6739 |
7247738 | CIF | C8 H4 N4 O3 | P 1 21/c 1 | 8.0979; 15.91; 18.7119 90; 95.287; 90 | 2400.54 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Fedyanin, Ivan V. What are the prospects of [1,2,5]oxadiazolo[3,4-c]cinnoline 5-oxides, 1,5-dioxides and their nitro derivatives as high-energy-density materials? Synthesis, experimental and predicted crystal structures, and calculated explosive properties CrystEngComm, 2023, 25, 6719-6739 |
7247739 | CIF | C8 H2 N6 O6 | P c a 21 | 12.53304; 8.30693; 9.61288 90; 90; 90 | 1000.81 | Baraboshkin, Nikita M.; Zelenov, Victor P.; Fedyanin, Ivan V. What are the prospects of [1,2,5]oxadiazolo[3,4-c]cinnoline 5-oxides, 1,5-dioxides and their nitro derivatives as high-energy-density materials? Synthesis, experimental and predicted crystal structures, and calculated explosive properties CrystEngComm, 2023, 25, 6719-6739 |
7247740 | CIF | C42 H35 Cu O3 P2 S | P 1 21/c 1 | 22.7584; 9.418; 18.1546 90; 112.265; 90 | 3601.1 | Srivastava, Devyani; Kushwaha, Aparna; Kociok-Köhn, Gabriele; Gosavi, Suresh W.; Chauhan, Ratna; Kumar, Abhinav; Muddassir, Mohd. The supramolecular frameworks and electrocatalytic properties of two new structurally diverse tertiary phosphane-appended nickel(ii) and copper(i) thiosquarates CrystEngComm, 2023, 25, 6822-6836 |
7247741 | CIF | C37.25 H33.73 Cl0.27 Ni O5.64 P2 S1.85 | P -1 | 9.658; 10.04345; 18.763 76.6204; 85.3079; 81.3483 | 1748.37 | Srivastava, Devyani; Kushwaha, Aparna; Kociok-Köhn, Gabriele; Gosavi, Suresh W.; Chauhan, Ratna; Kumar, Abhinav; Muddassir, Mohd. The supramolecular frameworks and electrocatalytic properties of two new structurally diverse tertiary phosphane-appended nickel(ii) and copper(i) thiosquarates CrystEngComm, 2023, 25, 6822-6836 |
7247742 | CIF | C24 H23 Br O S | P 21 21 21 | 6.8294; 14.2435; 20.7154 90; 90; 90 | 2015.08 | Fan, Xin-Yang; Li, Jia-Cheng; Zhou, Ji-Jia; Zhou, Bo; Ye, Long-Wu Chiral Brønsted acid-catalyzed asymmetric dearomative spirocyclization of alkynyl thioethers Green Chemistry, 2023, 25, 10638-10643 |
7247743 | CIF | C42 H32 B2 F4 N8 | P 1 21/c 1 | 11.505; 37.012; 9.556 90; 111.92; 90 | 3775 | Behera, Kanhu Charan; Ravikanth, Mangalampalli A white light emitting single halochromic hydrazine bridged bis(3-pyrrolyl BODIPY) fluorophore. Physical chemistry chemical physics : PCCP, 2023, 25, 32584-32593 |
7247745 | CIF | C20 H26 Cl Cu N9 O4 | P 1 21/c 1 | 7.0295; 27.8164; 12.8722 90; 99.071; 90 | 2485.5 | Diyali, Nilankar; Chettri, Meena; Saha, Subhajit; Saha, Ankita; Kundu, Subhankar; Mondal, Debasish; Dhak, Debasis; Biswas, Bhaskar Electrocatalytic hydrogen production activity with a copper(ii)-dipyridylamine complex in acidic water CrystEngComm, 2023, 25, 6837-6844 |
7247750 | CIF | C30 H18 Mn N4 O4 | P 1 2/n 1 | 7.959; 10.7872; 29.582 90; 93.461; 90 | 2535.1 | Li, Duqingcuo; Liu, Yichen; Xiang, Ruifang; Li, Yuyan; Qin, Tianrui; Dong, Xiu Yan; Sakiyama, Hiroshi; Muddassir, Mohd.; Liu, Jianqiang Synthesis, structure, and investigation of unique magnetic properties in two novel Mn-based coordination polymers CrystEngComm, 2023, 25, 6777-6785 |
7247751 | CIF | C24 H17 Mn N4 O5 | P -1 | 9.584; 10.552; 11.7635 93.832; 111.246; 108.96 | 1025.39 | Li, Duqingcuo; Liu, Yichen; Xiang, Ruifang; Li, Yuyan; Qin, Tianrui; Dong, Xiu Yan; Sakiyama, Hiroshi; Muddassir, Mohd.; Liu, Jianqiang Synthesis, structure, and investigation of unique magnetic properties in two novel Mn-based coordination polymers CrystEngComm, 2023, 25, 6777-6785 |
7247762 | CIF | C8.34 H11 Co N9.17 O0.17 | I -4 3 m | 17.1155; 17.1155; 17.1155 90; 90; 90 | 5013.8 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247763 | CIF | C8 H10 Co N10.44 | I -4 3 m | 16.9979; 16.9979; 16.9979 90; 90; 90 | 4911.2 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247764 | CIF | C10 H16 Co N4 O | I -4 3 m | 17.0426; 17.0426; 17.0426 90; 90; 90 | 4950 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247765 | CIF | C8 H10 Co N13.73 | I -4 3 m | 16.8057; 16.8057; 16.8057 90; 90; 90 | 4746.5 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247766 | CIF | C8 H10 Co N13 | I -4 3 m | 16.9247; 16.9247; 16.9247 90; 90; 90 | 4848 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247767 | CIF | C8 H10 Co N13.33 | I -4 3 m | 16.6284; 16.6284; 16.6284 90; 90; 90 | 4597.81 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247768 | CIF | C8 H10 Co N10.08 | I -4 3 m | 17.074; 17.074; 17.074 90; 90; 90 | 4977.4 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247769 | CIF | C10.92 H21.67 Co N4 O2.92 | I -4 3 m | 17.2086; 17.2086; 17.2086 90; 90; 90 | 5096.1 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247770 | CIF | C11.75 H25 Co N4 O3.75 | I -4 3 m | 17.223; 17.223; 17.223 90; 90; 90 | 5108.9 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247771 | CIF | C8 H10 Co N13.83 | I -4 3 m | 16.7265; 16.7265; 16.7265 90; 90; 90 | 4679.67 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247772 | CIF | C8 H10 Co N13.33 | I -4 3 m | 16.4992; 16.4992; 16.4992 90; 90; 90 | 4491.47 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247773 | CIF | C11.83 H25.33 Co N4 O3.83 | I -4 3 m | 17.164; 17.164; 17.164 90; 90; 90 | 5056.56 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247774 | CIF | C11 H19 Co N4 O1.5 | I -4 3 m | 17.1155; 17.1155; 17.1155 90; 90; 90 | 5013.82 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247775 | CIF | C12.5 H28 Co N4 O4.5 | I -4 3 m | 16.9823; 16.9823; 16.9823 90; 90; 90 | 4897.7 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247776 | CIF | C13.42 H31.67 Co N4 O5.42 | I -4 3 m | 17.1651; 17.1651; 17.1651 90; 90; 90 | 5057.54 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247777 | CIF | C12.83 H29.33 Co N4 O4.83 | I -4 3 m | 16.8677; 16.8677; 16.8677 90; 90; 90 | 4799.2 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247778 | CIF | C11.67 H21 Co N4 O1.83 | I -4 3 m | 16.923; 16.923; 16.923 90; 90; 90 | 4846.5 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247779 | CIF | C8 H10 Co N13.33 | I -4 3 m | 16.5684; 16.5684; 16.5684 90; 90; 90 | 4548.22 | Jones, Isabelle M.; Turner, Gemma F.; Pitts, Kari; Powell, Rees; Riboldi-Tunnicliffe, Alan; Williamson, Rachel; Boer, Stephanie; Allen, Lauren; Moggach, Stephen A. High-pressure induced guest-mediated gate opening behaviour of the Co-based framework ZIF-67 CrystEngComm, 2023, 25, 6533-6538 |
7247782 | CIF | C23 H26 F3 N3 O2 | P 1 21/c 1 | 11.276; 6.42; 29.326 90; 96.45; 90 | 2109.5 | Krawczyk, Marta S.; Krawczyk, Monika K.; Majerz, Irena Polymorphism of amantadinium niflumate CrystEngComm, 2023, 25, 6748-6757 |
7247783 | CIF | C23 H26 F3 N3 O2 | P 1 21/c 1 | 16.953; 6.359; 20.573 90; 108.29; 90 | 2105.8 | Krawczyk, Marta S.; Krawczyk, Monika K.; Majerz, Irena Polymorphism of amantadinium niflumate CrystEngComm, 2023, 25, 6748-6757 |
7247814 | CIF | C31 H26 Cd2 N4 O11 | P 1 2/c 1 | 10.3061; 8.9312; 16.601 90; 95.428; 90 | 1521.2 | Li, Wen-Ze; Sheng, Yu-Shu; Zhang, Xiao-Sa; Liu, Yu; Li, Jing; Luan, Jian Fabrication of 5-R-isophthalic acid-modulated cadmium–organic coordination polymers and selectivity for the efficient detection of multiple analytes CrystEngComm, 2023, 25, 6067-6079 |
7247815 | CIF | C15.5 H18 Cd N2 O8 | C 1 2/c 1 | 11.0328; 17.1307; 19.2872 90; 93.281; 90 | 3639.3 | Li, Wen-Ze; Sheng, Yu-Shu; Zhang, Xiao-Sa; Liu, Yu; Li, Jing; Luan, Jian Fabrication of 5-R-isophthalic acid-modulated cadmium–organic coordination polymers and selectivity for the efficient detection of multiple analytes CrystEngComm, 2023, 25, 6067-6079 |
7247816 | CIF | C23 H23 Cd N4 O8.5 | C 1 2/c 1 | 27.3243; 10.2895; 17.8117 90; 105.53; 90 | 4824.99 | Li, Wen-Ze; Sheng, Yu-Shu; Zhang, Xiao-Sa; Liu, Yu; Li, Jing; Luan, Jian Fabrication of 5-R-isophthalic acid-modulated cadmium–organic coordination polymers and selectivity for the efficient detection of multiple analytes CrystEngComm, 2023, 25, 6067-6079 |
7247817 | CIF | C33 H38 Cd2 N4 O15 | P -1 | 10.0583; 10.1823; 20.6673 97.263; 94.133; 119.439 | 1806.38 | Li, Wen-Ze; Sheng, Yu-Shu; Zhang, Xiao-Sa; Liu, Yu; Li, Jing; Luan, Jian Fabrication of 5-R-isophthalic acid-modulated cadmium–organic coordination polymers and selectivity for the efficient detection of multiple analytes CrystEngComm, 2023, 25, 6067-6079 |
7247818 | CIF | C9 H8 O4 | P 1 21/c 1 | 12.2633; 6.5624; 11.4726 90; 111.627; 90 | 858.28 | Muthusamy, Ramya; Karuppannan, Srinivasan Liquid–liquid phase separation and crystallization of aspirin polymorphs from a water–acetonitrile mixed solvent medium through a swift cooling process CrystEngComm, 2023, 25, 6611-6621 |
7247819 | CIF | C9 H8 O4 | P 1 21/c 1 | 11.429; 6.597; 11.395 90; 95.75; 90 | 854.8 | Muthusamy, Ramya; Karuppannan, Srinivasan Liquid–liquid phase separation and crystallization of aspirin polymorphs from a water–acetonitrile mixed solvent medium through a swift cooling process CrystEngComm, 2023, 25, 6611-6621 |
7247820 | CIF | C74 H101 Co2 Ho2 N7 O37 | C 1 2/c 1 | 26.692; 15.981; 19.803 90; 96.761; 90 | 8389 | Ahmed, Naushad; Sahu, Prem Prakash Ferromagnetically coupled CoII2LnIII2 complexes (where LnIII = Ho, Er, Yb): experimental and theoretical investigations CrystEngComm, 2023, 25, 6592-6601 |
7247821 | CIF | C74 H101 Co2 N7 O37 Yb2 | C 1 2/c 1 | 26.7585; 16.0409; 19.8206 90; 96.4; 90 | 8454.6 | Ahmed, Naushad; Sahu, Prem Prakash Ferromagnetically coupled CoII2LnIII2 complexes (where LnIII = Ho, Er, Yb): experimental and theoretical investigations CrystEngComm, 2023, 25, 6592-6601 |
7247831 | CIF | C50 H33 N3 O2 | R -3 :H | 39.4459; 39.4459; 12.5093 90; 90; 120 | 16856.5 | Amiri, Kamran; Nayebzadeh, Behrouz; Kamangar, Mohammad; Babazadeh, Mohammad; Ariafard, Alireza; Shiri, Farshad; Rominger, Frank; Balalaie, Saeed Synthesis of a fused N-bridged [3.3.1]nonadiquinoline multicyclic skeleton via a metal-free formal [4 + 2] cycloaddition/Mannich/dearomatization domino reaction Green Chemistry, 2023, 25, 9203-9208 |
7247832 | CIF | C4 H9 O11 | P -1 | 6.345; 7.2323; 10.5606 94.218; 100.28; 97.907 | 469.9 | Ragupathi, Ayyakkannu; Charpe, Vaibhav Pramod; Hwu, Jih Ru; Hwang, Kuo Chu Oxidative destruction of chlorinated persistent organic pollutants by hydroxyl radicals via ozone and UV light irradiation Green Chemistry, 2023, 25, 9695-9704 |
9004190 | CIF | As Ca Co0.04 Cu0.01 H Mg0.06 Ni0.67 O5 Zn0.22 | P 21 21 21 | 7.455; 8.955; 5.916 90; 90; 90 | 394.949 | Cesbron, F. P.; Ginderow, D.; Giraud, R.; Pelisson, P.; Pillard, F. La nickelaustinite Ca(Ni,Zn)(AsO4)(OH): Nouvelle espece minerale du district cobalto-nickelifere de Bou-Azzer, Maroc Note: signs changed on y-coordinates of O1 and O2 The Canadian Mineralogist, 1987, 25, 401-407 |
9004191 | CIF | Al K0.95 Na0.05 O8 Si3 | C -1 | 8.5714; 12.9646; 7.2217 90.6; 115.9; 87.7 | 721.3 | Blasi, A.; De Pol Blasi, C.; Zanazzi, P. F. A re-examination of the Pellotsalo microcline: Mineralogical implications and genetic considerations The Canadian Mineralogist, 1987, 25, 527-537 |
9004192 | CIF | B3 K Na2 O30 Si12 | P 6/m c c | 10.253; 10.253; 13.503 90; 90; 120 | 1229.31 | Grice, J. D.; Ercit, T. S.; Van Velthuizen, J.; Dunn, P. J. Poudretteite, KNa2B3Si12O30, a new member of the osumilite group from Mont Saint-Hilaire, Quebec, and its crystal structure The Canadian Mineralogist, 1987, 25, 763-766 |
9004193 | CIF | Be Ca2 H9 O16 P3 Zn | P -1 | 7.13; 7.43; 12.479 94.3; 102.1; 82.7 | 640.363 | Hawthorne, F. C.; Grice, J. D. The crystal structure of ehrleite, a tetrahedral sheet structure The Canadian Mineralogist, 1987, 25, 767-774 |
9006525 | CIF | Al2 O5 Si | P b n m | 7.4857; 7.675; 5.7751 90; 90; 90 | 331.795 | Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.; Downs, R. T. Compressibility and crystal structure of sillimanite, Al2SiO5, at high pressure Sample: P = 0.00 GPa Physics and Chemistry of Minerals, 1997, 25, 39-47 |
9006526 | CIF | Al2 O5 Si | P b n m | 7.4732; 7.652; 5.7631 90; 90; 90 | 329.562 | Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.; Downs, R. T. Compressibility and crystal structure of sillimanite, Al2SiO5, at high pressure Sample: P = 1.23 GPa Physics and Chemistry of Minerals, 1997, 25, 39-47 |
9006527 | CIF | Al2 O5 Si | P b n m | 7.4537; 7.6238; 5.756 90; 90; 90 | 327.088 | Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.; Downs, R. T. Compressibility and crystal structure of sillimanite, Al2SiO5, at high pressure Sample: P = 2.54 GPa Physics and Chemistry of Minerals, 1997, 25, 39-47 |
9006528 | CIF | Al2 O5 Si | P b n m | 7.4345; 7.5989; 5.7507 90; 90; 90 | 324.88 | Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.; Downs, R. T. Compressibility and crystal structure of sillimanite, Al2SiO5, at high pressure Sample: P = 3.72 GPa Physics and Chemistry of Minerals, 1997, 25, 39-47 |
9006529 | CIF | Al2 O5 Si | P b n m | 7.4146; 7.5739; 5.745 90; 90; 90 | 322.624 | Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.; Downs, R. T. Compressibility and crystal structure of sillimanite, Al2SiO5, at high pressure Sample: P = 5.29 GPa Physics and Chemistry of Minerals, 1997, 25, 39-47 |
9006530 | CIF | D2 Mn O2 | P -3 m 1 | 3.318; 3.318; 4.717 90; 90; 120 | 44.973 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 0.0 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006531 | CIF | D2 Mn O2 | P -3 m 1 | 3.305; 3.305; 4.675 90; 90; 120 | 44.224 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 0.7 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006532 | CIF | D2 Mn O2 | P -3 m 1 | 3.281; 3.281; 4.579 90; 90; 120 | 42.689 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 2.4 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006533 | CIF | D2 Mn O2 | P -3 m 1 | 3.25; 3.25; 4.497 90; 90; 120 | 41.136 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 4.6 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006534 | CIF | D2 Mn O2 | P -3 m 1 | 3.208; 3.208; 4.416 90; 90; 120 | 39.358 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 7.8 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006535 | CIF | Co D2 O2 | P -3 m 1 | 3.1834; 3.1834; 4.6445 90; 90; 120 | 40.762 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 0.0 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006536 | CIF | Co D2 O2 | P -3 m 1 | 3.167; 3.167; 4.6 90; 90; 120 | 39.956 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 0.5 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006537 | CIF | Co D2 O2 | P -3 m 1 | 3.139; 3.139; 4.483 90; 90; 120 | 38.254 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 3.3 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006538 | CIF | Co D2 O2 | P -3 m 1 | 3.109; 3.109; 4.414 90; 90; 120 | 36.949 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 5.6 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006539 | CIF | Co D2 O2 | P -3 m 1 | 3.084; 3.084; 4.363 90; 90; 120 | 35.937 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 7.5 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006540 | CIF | Co D2 O2 | P -3 m 1 | 3.059; 3.059; 4.283 90; 90; 120 | 34.709 | Parise, J. B.; Theroux, B.; Li, R.; Loveday, J. S.; Marshall, W. G.; Klotz, S. Pressure dependence of hydrogen bonding in metal deuteroxides: a neutron powder diffraction study of Mn(OD)2 and beta-Co(OD)2. Sample: P = 9.5 GPa Physics and Chemistry of Minerals, 1998, 25, 130-137 |
9006541 | CIF | Mn7 O12 Si | I 41/a c d :2 | 9.4264; 9.4264; 18.6962 90; 90; 90 | 1661.29 | Miletich, R.; Allan, D. R.; Angel, R. J. Structural control of polyhedral compression in synthetic braunite, Mn2+Mn3+6O8SiO4 Sample in air: P = 0.0001 GPa Physics and Chemistry of Minerals, 1998, 25, 183-192 |
9006542 | CIF | Mn7 O12 Si | I 41/a c d :2 | 9.4266; 9.4266; 18.6952 90; 90; 90 | 1661.27 | Miletich, R.; Allan, D. R.; Angel, R. J. Structural control of polyhedral compression in synthetic braunite, Mn2+Mn3+6O8SiO4 Sample in Diamond Anvil Cell without pressure medium: P = 0.0001 GPa Physics and Chemistry of Minerals, 1998, 25, 183-192 |
9006543 | CIF | Mn7 O12 Si | I 41/a c d :2 | 9.4007; 9.4007; 18.6574 90; 90; 90 | 1648.81 | Miletich, R.; Allan, D. R.; Angel, R. J. Structural control of polyhedral compression in synthetic braunite, Mn2+Mn3+6O8SiO4 Sample: P = 1.38 GPa Physics and Chemistry of Minerals, 1998, 25, 183-192 |
9006544 | CIF | Mn7 O12 Si | I 41/a c d :2 | 9.3786; 9.3786; 18.6234 90; 90; 90 | 1638.08 | Miletich, R.; Allan, D. R.; Angel, R. J. Structural control of polyhedral compression in synthetic braunite, Mn2+Mn3+6O8SiO4 Sample: P = 2.66 GPa Physics and Chemistry of Minerals, 1998, 25, 183-192 |
9006545 | CIF | Mn7 O12 Si | I 41/a c d :2 | 9.348; 9.348; 18.5739 90; 90; 90 | 1623.08 | Miletich, R.; Allan, D. R.; Angel, R. J. Structural control of polyhedral compression in synthetic braunite, Mn2+Mn3+6O8SiO4 Sample: P = 4.51 GPa Physics and Chemistry of Minerals, 1998, 25, 183-192 |
9006546 | CIF | Mn7 O12 Si | I 41/a c d :2 | 9.3309; 9.3309; 18.5455 90; 90; 90 | 1614.68 | Miletich, R.; Allan, D. R.; Angel, R. J. Structural control of polyhedral compression in synthetic braunite, Mn2+Mn3+6O8SiO4 Sample: P = 5.63 GPa Physics and Chemistry of Minerals, 1998, 25, 183-192 |
9006547 | CIF | Mn7 O12 Si | I 41/a c d :2 | 9.2998; 9.2998; 18.4957 90; 90; 90 | 1599.62 | Miletich, R.; Allan, D. R.; Angel, R. J. Structural control of polyhedral compression in synthetic braunite, Mn2+Mn3+6O8SiO4 Sample: P = 7.69 GPa Physics and Chemistry of Minerals, 1998, 25, 183-192 |
9006555 | CIF | Fe0.39 Mg0.61 O3 Si | P 1 21/c 1 | 9.6519; 8.9075; 5.2004 90; 108.59; 90 | 423.773 | Angel, R. J.; McCammon, C. A.; Woodland, A. B. Structure, ordering and cation interactions in Ca-free P2_1/c clinopyroxenes Sample: H162 Note: x coordinate of O2B changed by author, May, 2004 Physics and Chemistry of Minerals, 1998, 25, 249-258 |
9006556 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.4545; 11.4545; 11.4545 90; 90; 90 | 1502.89 | Zhang, L.; Ahsbahs, H.; Kutoglu, A. Hydrostatic compression and crystal structure of pyrope to 33 GPa Sample: P = 0.0 GPa Physics and Chemistry of Minerals, 1998, 25, 301-307 |
9006557 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.3846; 11.3846; 11.3846 90; 90; 90 | 1475.55 | Zhang, L.; Ahsbahs, H.; Kutoglu, A. Hydrostatic compression and crystal structure of pyrope to 33 GPa Sample: P = 3.48 GPa Physics and Chemistry of Minerals, 1998, 25, 301-307 |
9006558 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.2893; 11.2893; 11.2893 90; 90; 90 | 1438.8 | Zhang, L.; Ahsbahs, H.; Kutoglu, A. Hydrostatic compression and crystal structure of pyrope to 33 GPa Sample: P = 8.57 GPa Physics and Chemistry of Minerals, 1998, 25, 301-307 |
9006559 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.2353; 11.2353; 11.2353 90; 90; 90 | 1418.25 | Zhang, L.; Ahsbahs, H.; Kutoglu, A. Hydrostatic compression and crystal structure of pyrope to 33 GPa Sample: P = 11.53 GPa Physics and Chemistry of Minerals, 1998, 25, 301-307 |
9006560 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.1717; 11.1717; 11.1717 90; 90; 90 | 1394.31 | Zhang, L.; Ahsbahs, H.; Kutoglu, A. Hydrostatic compression and crystal structure of pyrope to 33 GPa Sample: P = 15.28 GPa Physics and Chemistry of Minerals, 1998, 25, 301-307 |
9006561 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.0335; 11.0335; 11.0335 90; 90; 90 | 1343.2 | Zhang, L.; Ahsbahs, H.; Kutoglu, A. Hydrostatic compression and crystal structure of pyrope to 33 GPa Sample: P = 24.07 GPa Physics and Chemistry of Minerals, 1998, 25, 301-307 |
9006562 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 10.9339; 10.9339; 10.9339 90; 90; 90 | 1307.15 | Zhang, L.; Ahsbahs, H.; Kutoglu, A. Hydrostatic compression and crystal structure of pyrope to 33 GPa Sample: P = 32.47 GPa Physics and Chemistry of Minerals, 1998, 25, 301-307 |
9006563 | CIF | Al1.388 Ca0.742 Fe0.162 Mg0.016 O6 Si1.5 | C 1 2/c 1 | 9.719; 8.814; 5.305 90; 106.04; 90 | 436.752 | Okui, M.; Sawada, H.; Marumo, F. Structure refinement of a nonstoichiometric pyroxene synthesized under ambient pressure Physics and Chemistry of Minerals, 1998, 25, 318-322 |
9006564 | CIF | Al0.536 Fe2 H2 Na0.5 O12 Si3.464 | C 1 2/m 1 | 5.277; 9.14; 9.78 90; 101; 90 | 463.04 | Manceau, A.; Chateigner, D.; Gates, W. P. Polarized EXAFS, distance-valence least-squares modelling (DVLS), and quantitative texture analysis approaches to the structural refinement of Garfield nontronite Physics and Chemistry of Minerals, 1998, 25, 347-365 |
9006565 | CIF | Fe6.5 H2 Mg0.1 Mn0.4 O24 Si8 | P n m n | 9.388; 18.387; 5.347 90; 90; 90 | 922.984 | Sueno, S.; Matsuura, S.; Gibbs, G. V.; Boisen, M. B. A crystal chemical study of protoanthophyllite: orthoamphiboles with the protoamphibole structure Sample: PFA Hiruka Village Physics and Chemistry of Minerals, 1998, 25, 366-377 |
9006566 | CIF | Fe4.699 H2 Mg0.901 Mn1.4 O24 Si8 | P n m n | 9.425; 18.303; 5.345 90; 90; 90 | 922.043 | Sueno, S.; Matsuura, S.; Gibbs, G. V.; Boisen, M. B. A crystal chemical study of protoanthophyllite: orthoamphiboles with the protoamphibole structure Sample: PMFA Yokene Mine Physics and Chemistry of Minerals, 1998, 25, 366-377 |
9006567 | CIF | Cd K2 O4 Si | F -4 3 m | 7.947; 7.947; 7.947 90; 90; 90 | 501.891 | Dollase, W. A. Transformations of the stuffed cristobalites, K2MSiO4, M = Mg, Zn, Co, Cd, with temperature and composition Physics and Chemistry of Minerals, 1998, 25, 389-392 |
9006568 | CIF | Ca O5 Si2 | P -1 | 7.243; 7.546; 6.501 81.43; 84.82; 69.6 | 329.031 | Kudoh, Y.; Kanzaki, M. Crystal chemical characteristics of alpha-CaSi2O5, a new high pressure calcium silicate with five-coordinated silicon synthesized at 1500 C and 10 GPa Physics and Chemistry of Minerals, 1998, 25, 429-433 |
9006569 | CIF | Al1.839 Cr0.078 Fe0.283 Mg0.777 Ni0.014 O4 Si0.003 Zn0.007 | F d -3 m :2 | 8.1252; 8.1252; 8.1252 90; 90; 90 | 536.417 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: TS11B1, unheated, T = 25 C Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006570 | CIF | Al1.835 Cr0.078 Fe0.29 Mg0.774 Ni0.014 O4 Si0.002 Zn0.007 | F d -3 m :2 | 8.1233; 8.1233; 8.1233 90; 90; 90 | 536.04 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: TS11B2, quenched from T = 1150 C after 3 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006571 | CIF | Al1.839 Cr0.078 Fe0.283 Mg0.777 Ni0.014 O4 Si0.003 Zn0.007 | F d -3 m :2 | 8.1218; 8.1218; 8.1218 90; 90; 90 | 535.743 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: TS11B3, quenched from T = 1150 C after 5 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006572 | CIF | Al1.835 Cr0.079 Fe0.221 Mg0.775 Ni0.014 O4 Zn0.007 | F d -3 m :2 | 8.107; 8.107; 8.107 90; 90; 90 | 532.82 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: TS11B4, quenched from T = 1150 C after 27 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006573 | CIF | Al1.84 Cr0.078 Fe0.213 Mg0.776 Ni0.014 O4 Si0.003 Zn0.007 | F d -3 m :2 | 8.1082; 8.1082; 8.1082 90; 90; 90 | 533.057 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: TS11B5, quenched from T = 1150 C after 49 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006574 | CIF | Al1.838 Cr0.078 Fe0.216 Mg0.776 Ni0.014 O4 Si0.002 Zn0.007 | F d -3 m :2 | 8.106; 8.106; 8.106 90; 90; 90 | 532.623 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: TS11B6, quenched from T = 1150 C after 202 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006575 | CIF | Al1.839 Cr0.078 Fe0.216 Mg0.776 Ni0.014 O4 Si0.002 Zn0.007 | F d -3 m :2 | 8.111; 8.111; 8.111 90; 90; 90 | 533.609 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: TS11B7, temperature lowered from T = 1150 C to 280 C in 117 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006576 | CIF | Al1.808 Cr0.127 Fe0.225 Mg0.825 Ni0.008 O4 Si0.001 Ti0.004 Zn0.002 | F d -3 m :2 | 8.1259; 8.1259; 8.1259 90; 90; 90 | 536.555 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: LE20A1, unheated Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006577 | CIF | Al1.802 Cr0.125 Fe0.219 Mg0.808 Ni0.008 O4 Si0.001 Ti0.004 Zn0.002 | F d -3 m :2 | 8.1171; 8.1171; 8.1171 90; 90; 90 | 534.814 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: LE20A3, quenched from T = 1150 C after 0.5 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006578 | CIF | Al1.775 Cr0.125 Fe0.218 Mg0.808 Ni0.008 O4 Si0.002 Ti0.004 Zn0.002 | F d -3 m :2 | 8.1166; 8.1166; 8.1166 90; 90; 90 | 534.715 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: LE20A4, quenched from T = 1150 C after 5.5 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006579 | CIF | Al1.771 Cr0.125 Fe0.222 Mg0.808 Ni0.009 O4 Si0.001 Ti0.004 Zn0.002 | F d -3 m :2 | 8.1142; 8.1142; 8.1142 90; 90; 90 | 534.241 | Menegazzo, G.; Carbonin, S. Oxidation mechanisms in Al-Mg-Fe spinels. A second stage: alpha-Fe2O3 exsolution Sample: LE20A5, quenched from T = 1150 C after 30.5 hours Physics and Chemistry of Minerals, 1998, 25, 541-547 |
9006580 | CIF | Al O3 Sc | P b n m | 4.9371; 5.2322; 7.2042 90; 90; 90 | 186.098 | Ross, N. L. High pressure study of ScAlO3 perovskite Sample: P = 0.0 GPa Physics and Chemistry of Minerals, 1998, 25, 597-602 |
9006581 | CIF | Al O3 Sc | P b n m | 4.9192; 5.2155; 7.1684 90; 90; 90 | 183.913 | Ross, N. L. High pressure study of ScAlO3 perovskite Sample: P = 2.58 GPa Physics and Chemistry of Minerals, 1998, 25, 597-602 |
9006582 | CIF | Al O3 Sc | P b n m | 4.9149; 5.2121; 7.162 90; 90; 90 | 183.469 | Ross, N. L. High pressure study of ScAlO3 perovskite Sample: P = 3.21 GPa Physics and Chemistry of Minerals, 1998, 25, 597-602 |
9006583 | CIF | Al O3 Sc | P b n m | 4.904; 5.2033; 7.1416 90; 90; 90 | 182.232 | Ross, N. L. High pressure study of ScAlO3 perovskite Sample: P = 4.72 GPa Physics and Chemistry of Minerals, 1998, 25, 597-602 |
9007508 | CIF | B F4 K | P n m a | 8.6588; 5.48; 7.0299 90; 90; 90 | 333.57 | Brunton, G. The crystal structure of KBF4 Acta Crystallographica, Section B, 1969, 25, 2161-2162 |
9007509 | CIF | Al2.71 Ca1.9 Fe0.15 H3 Mg0.45 O14 Si2.79 | A 1 2/m 1 | 8.83; 5.9; 19.17 90; 97.12; 90 | 990.998 | Galli, E.; Alberti, A. On the crystal structure of pumpellyite Acta Crystallographica, Section B, 1969, 25, 2276-2281 |
9009594 | CIF | Al2.126 Ca2 H22 O15.72 Si1.434 | P 63/m | 5.755; 5.755; 25.12 90; 90; 120 | 720.512 | Galli, E.; Passaglia, E. Vertumnite: its crystal structure and relationship with natural and synthetic phases Locality: Campomorto, Montalto di Castro Tschermaks Mineralogische und Petrographische Mitteilungen, 1978, 25, 33-46 |
9009595 | CIF | Al F7 Mg Na2 | I m m a | 7.06; 10; 7.303 90; 90; 90 | 515.592 | Giuseppetti, G.; Tadini, C. Re-examination of the crystal structure of weberite Tschermaks Mineralogische und Petrographische Mitteilungen, 1978, 25, 57-62 |
9009596 | CIF | Fe2 H14 Mn O16 P2 | P -1 | 10.228; 9.837; 7.284 90.17; 98.44; 117.44 | 641.284 | Fanfani, L.; Tomassini, M.; Zanazzi, P. F.; Zanzari, A. R. The crystal structure of strunzite, a contribution to the crystal chemistry of basic ferric-manganous hydrated phosphates Tschermaks Mineralogische und Petrographische Mitteilungen, 1978, 25, 77-87 |
9009597 | CIF | As3 H Mn O9 Pb3 | P 1 n 1 | 7.26; 6.78; 11.09 90; 91.5; 90 | 545.694 | Pertlik, F. The crystal structure of trigonite, Pb3Mn(AsO3)2(AsO2(OH)) Tschermaks Mineralogische und Petrographische Mitteilungen, 1978, 25, 95-105 |
9009598 | CIF | As2 Fe0.65 H2.65 O9 Pb2 Zn0.35 | P 1 21/m 1 | 7.763; 6.046; 9.022 90; 112.5; 90 | 391.215 | Hofmeister, W.; Tillmanns, E. Strukturelle untersuchungen an arsenbrackebuschit Tschermaks Mineralogische und Petrographische Mitteilungen, 1978, 25, 153-163 |
9009907 | CIF | As2 Ir | P 1 21/c 1 | 6.0549; 6.0717; 6.1587 90; 113.197; 90 | 208.111 | Kjekshus, A. On the properties of binary compounds with the CoSb2 type crystal structure Acta Chemica Scandinavica, 1971, 25, 411-422 |
9009908 | CIF | As2 Co | P 1 21/c 1 | 5.9106; 5.868; 5.9587 90; 116.432; 90 | 185.064 | Kjekshus, A. On the properties of binary compounds with the CoSb2 type crystal structure Acta Chemica Scandinavica, 1971, 25, 411-422 |
9009909 | CIF | Cu O3 Te | P m c n | 7.604; 5.837; 12.705 90; 90; 90 | 563.906 | Lindqvist, O. On the crystal structures of CuTeO3 and CuTe2O5 Acta Chemica Scandinavica, 1971, 25, 740-740 |
9011089 | CIF | Ga | C 1 2/c 1 | 2.766; 8.053; 3.332 90; 92.02; 90 | 74.173 | Bosio, L.; Defrain, A.; Curien, H.; Rimsky, A. Structure cristalline du gallium-beta Sample: at T = 248.15 K Note: structure known as beta phase Acta Crystallographica, Section B, 1969, 25, 995-995 |
9011090 | CIF | Fe7 O10 Si | P 1 21/m 1 | 21.4; 3.06; 5.88 90; 98; 90 | 381.299 | Smuts, J.; Steyn, J. G. D.; Boeyens, J. C. A. The crystal structure of an iron silicate, iscorite Acta Crystallographica, Section B, 1969, 25, 1251-1255 |
9011091 | CIF | Ca5 H O13 P3 | P 63/m | 9.424; 9.424; 6.879 90; 90; 120 | 529.086 | Sudarsanan, K.; Young, R. A. Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-4 Acta Crystallographica, Section B, 1969, 25, 1534-1543 |
9011092 | CIF | Ca5 H O13 P3 | P 63/m | 9.424; 9.424; 6.879 90; 90; 120 | 529.086 | Sudarsanan, K.; Young, R. A. Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-6 Acta Crystallographica, Section B, 1969, 25, 1534-1543 |
9011093 | CIF | Ca5 H O13 P3 | P 63/m | 9.424; 9.424; 6.879 90; 90; 120 | 529.086 | Sudarsanan, K.; Young, R. A. Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: X-23-10 Acta Crystallographica, Section B, 1969, 25, 1534-1543 |
9011094 | CIF | Ca5 H O13 P3 | P 63/m | 9.424; 9.424; 6.879 90; 90; 120 | 529.086 | Sudarsanan, K.; Young, R. A. Significant precision in crystal structural details: Holly Springs hydroxyapatite Locality: Holly Springs, Cherokee County, Georgia, USA Sample: Neutron Acta Crystallographica, Section B, 1969, 25, 1534-1543 |
9011099 | CIF | Cl Fe2 O12 Te4 | P -1 | 8.89; 5.08; 6.63 103.17; 107.08; 77.87 | 275.366 | Dusausoy, Y.; Protas, J. Determination et etude de la structure cristalline de la rodalquilarite, chlorotellurite acide de fer Acta Crystallographica, Section B, 1969, 25, 1551-1558 |
9011100 | CIF | C H30 Ca3 Mn O25 S | P 63 | 11.06; 11.06; 10.5 90; 90; 120 | 1112.32 | Granger, M. M.; Protas, J. Determination et etude de la structure cristalline de la jouravskite Ca3MnIV(SO4)(CO3)(OH)*12(H2O) Acta Crystallographica, Section B, 1969, 25, 1943-1951 |
9011101 | CIF | B5 H4 N O10 | P 1 21/c 1 | 9.47; 7.63; 11.65 90; 97.08; 90 | 835.365 | Merlino, S.; Sartori, F. The crystal structure of lardellite, NH4B5O7(OH)2*H2O Acta Crystallographica, Section B, 1969, 25, 2264-2270 |
9011102 | CIF | C H20 Na2 O13 | C 1 c 1 | 12.83; 9.026; 13.44 90; 123; 90 | 1305.31 | Taga, T. Crystal structure of Na2CO3*10H2O Acta Crystallographica, Section B, 1969, 25, 2656-2657 |
9011602 | CIF | Al | F m -3 m | 4.046; 4.046; 4.046 90; 90; 90 | 66.233 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9011603 | CIF | Ni | F m -3 m | 3.499; 3.499; 3.499 90; 90; 90 | 42.838 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9011604 | CIF | Cu | F m -3 m | 3.597; 3.597; 3.597 90; 90; 90 | 46.539 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1,2 & 3 Physical Review, 1925, 25, 753-761 |
9011605 | CIF | Mo | I m -3 m | 3.142; 3.142; 3.142 90; 90; 90 | 31.018 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9011606 | CIF | Mo | I m -3 m | 3.136; 3.136; 3.136 90; 90; 90 | 30.841 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 3 & 4 Physical Review, 1925, 25, 753-761 |
9011607 | CIF | Ag | F m -3 m | 4.079; 4.079; 4.079 90; 90; 90 | 67.867 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9011608 | CIF | Ag | F m -3 m | 4.058; 4.058; 4.058 90; 90; 90 | 66.825 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 3 & 4 Physical Review, 1925, 25, 753-761 |
9011609 | CIF | W | I m -3 m | 3.155; 3.155; 3.155 90; 90; 90 | 31.405 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9011610 | CIF | W | I m -3 m | 3.157; 3.157; 3.157 90; 90; 90 | 31.465 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: run 3 Physical Review, 1925, 25, 753-761 |
9011611 | CIF | W | I m -3 m | 3.158; 3.158; 3.158 90; 90; 90 | 31.495 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 3 & 4 Physical Review, 1925, 25, 753-761 |
9011612 | CIF | Au | F m -3 m | 4.065; 4.065; 4.065 90; 90; 90 | 67.171 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9011613 | CIF | Au | F m -3 m | 4.073; 4.073; 4.073 90; 90; 90 | 67.568 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1,2 & 3 Physical Review, 1925, 25, 753-761 |
9011614 | CIF | Bi | P 63/m m c | 4.539; 4.539; 11.829 90; 90; 120 | 211.057 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9011655 | CIF | Sc | P 4/n m m :1 | 4.73; 4.73; 3.18 90; 90; 90 | 71.146 | Vohra, Y. K.; Grosshans, W.; Holzapfel, W. B. High-pressure phase transformation in scandium Sample: at P = 33.5 GPa Physical Review B, 1982, 25, 6019-6021 |
9011876 | CIF | Ca5 H2 O10 Si2 | P 1 1 21/b | 8.9207; 11.4481; 5.0759 90; 90; 108.32 | 492.103 | Kuznetsova, T. P.; Nevskii, N. N.; Ilyukhin, V. V.; Belov, N. V. Refinement of the crystal structure of calcium chondrodite Ca5[SiO4]2(OH)2=Ca(OH)2*2Ca2SiO4 Locality: synthetic Soviet Physics Crystallography, 1980, 25, 91-92 |
9011877 | CIF | Ca2 Na6 O14 P2 Si2 | P 1 2/c 1 | 7.303; 12.201; 14.715 90; 91.93; 90 | 1310.42 | Krutik, V. M.; Pushcharovsky, D. Y.; Khomyakov, A. P.; Pobedimskaya, E. A.; Belov, N. V. Anion radical of mixed type (four [S4O12] rings and P orthotetrahedra) in the structure of monoclinic fosinaite Soviet Physics Crystallography, 1980, 25, 138-142 |
9011878 | CIF | Ce2 H8 Na4 O33 Si12 | P m m 2 | 7.5; 15.62; 7.35 90; 90; 90 | 861.052 | Shumyatskaya, N. G.; Voronkov, A. A.; Pyatenko, Y. A. Sazhinite, Na2Ce[Si6O14(OH)]*nH2O: a new representative of the dalyite family in crystal chemistry Soviet Physics Crystallography, 1980, 25, 419-423 |
9011899 | CIF | C Mn Na3 O7 P | P 1 21/m 1 | 8.997; 6.741; 5.163 90; 90.16; 90 | 313.128 | Kurova, T. A.; Shumyatskaya, N. G.; Voronkov, A. A.; Pyatenko, Y. A. Crystal structure of sidorenkite Na3Mn(PO4)(CO3) Soviet Physics Doklady, 1980, 25, 156-157 |
9011900 | CIF | B2 Ca Fe0.11 Mg0.89 O5 | P 1 1 21/b | 12.45; 5.514; 11.145 90; 90; 104.13 | 741.948 | Simonov, M. A.; Egorov-Tismenko Y K; Yamnova, M. A.; Belokoneva, E. L.; Belov, N. V. Crystal structure of natural monoclinic kurchatovite Ca2(Mg0.86Fe0.14)(Mg0.92Fe0.08)[B2O5]2 Soviet Physics Doklady, 1980, 25, 1125-1128 |
9012513 | CIF | Fe5 H6 O20 P4 | C 1 2/c 1 | 17.492; 9.038; 9.349 90; 96.23; 90 | 1469.28 | Corbin, D. R.; Whitney, J. F.; Fultz, W. C.; Stucky, G. D.; Eddy, M. M.; Cheetham, A. K. Synthesis of open-framework transition-metal phosphates using organometallic precursors in acidic media. Preparation and structural characterization of Fe5P4O20H10 and NaFe3P3O12 Note: structure from ICSD Inorganic Chemistry, 1986, 25, 2279-2280 |
9012514 | CIF | Fe3 Na O12 P3 | C 1 2/c 1 | 11.998; 12.328; 6.5 90; 114.185; 90 | 877.037 | Corbin, D. R.; Whitney, J. F.; Fultz, W. C.; Stucky, G. D.; Eddy, M. M.; Cheetham, A. K. Synthesis of open-framework transition-metal phosphates using organometallic precursors in acidic media. Preparation and structural characterization of Fe5P4O20H10 and NaFe3P3O12 Note: structure from ICSD Inorganic Chemistry, 1986, 25, 2279-2280 |
9012547 | CIF | H3 Na O5 S | C 1 c 1 | 7.799; 7.79; 8.23 90; 119.95; 90 | 433.237 | Grimvall, S. The crystal structure of NaHSO4H2O Acta Chemica Scandinavica, 1971, 25, 3213-3219 |
9013144 | CIF | Ca0.44 Ce2.1 Fe1.72 La1.46 Mg0.4 Nb0.04 O22 Si4 Ti2.84 | P 1 21/a 1 | 13.4656; 5.7356; 11.0977 90; 100.636; 90 | 842.386 | Li, G.; Yang, G.; Ma, Z.; Shi, N.; Xiong, M.; Sheng, G.; Fan, H. The crystal structure of a new mineral dingdaohengite-(Ce) Kuangwu Xuebao, 2005, 25, 313-320 |
9013145 | CIF | Ca0.44 Ce2.1 Fe1.72 La1.46 Mg0.4 Nb0.04 O22 Si4 Ti2.84 | C 1 2/m 1 | 13.4656; 5.7356; 11.0977 90; 100.636; 90 | 842.386 | Li, G.; Yang, G.; Ma, Z.; Shi, N.; Xiong, M.; Sheng, G.; Fan, H. The crystal structure of a new mineral dingdaohengite-(Ce) Kuangwu Xuebao, 2005, 25, 313-320 |
9013414 | CIF | Fe | I m -3 m | 2.858; 2.858; 2.858 90; 90; 90 | 23.345 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9013415 | CIF | Fe | I m -3 m | 2.855; 2.855; 2.855 90; 90; 90 | 23.271 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 3 & 4 Physical Review, 1925, 25, 753-761 |
9013416 | CIF | Pd | F m -3 m | 3.859; 3.859; 3.859 90; 90; 90 | 57.468 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9013417 | CIF | Pt | F m -3 m | 3.912; 3.912; 3.912 90; 90; 90 | 59.868 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of three runs Physical Review, 1925, 25, 753-761 |
9013418 | CIF | Pb | F m -3 m | 4.92; 4.92; 4.92 90; 90; 90 | 119.095 | Davey, W. P. Lattice constants of twelve common metals Locality: synthetic Note: lattice parameter is average of runs 1 & 2 Physical Review, 1925, 25, 753-761 |
9013469 | CIF | Ca2 Fe2 O5 | P n m a | 5.4253; 14.7687; 5.598 90; 90; 90 | 448.538 | Berggren, J. Refinement of the crystal structure of dicalcium ferrite, Ca2Fe2O5 Acta Chemica Scandinavica, 1971, 25, 3616-3624 |
9014118 | CIF | Na Nb O3 | P b m a | 5.566; 15.52; 5.506 90; 90; 90 | 475.632 | Sakowski-Cowley A C; Lukaszewicz, K.; Megaw, H. D. The structure of sodium niobate at room temperature, and the problem of reliability in pseudosymmetric structures Acta Crystallographica, Section B, 1969, 25, 851-865 |
9014372 | CIF | Al6 B3 F Fe3 Na O30 Si6 | R 3 m :H | 15.869; 15.869; 7.188 90; 90; 120 | 1567.61 | Barton, R. Refinement of the crystal structure of buergerite and the absolute orientation of tourmalines Acta Crystallographica, Section B, 1969, 25, 1524-1533 |
9015441 | CIF | N O6 P V | P b c a | 6.8064; 9.2567; 17.732 90; 90; 90 | 1117.2 | Amoros, P.; Beltran-Porter D; Le Bail, A.; Ferey, G.; Villeneuve, G. Crystal structure of A(VO2)(HPO4)(A=NH4,K,Rb) solved from X-ray powder diffraction _cod_database_code 1000080 European Journal of Solid State and Inorganic Chemistry, 1988, 25, 599-607 |
9015591 | CIF | Li Nb3 O8 | P 1 21/a 1 | 15.262; 5.033; 7.457 90; 107.34; 90 | 546.767 | Lundberg, M. The crystal structure of LiNb3O8 Note: isostructural with lithiotantite Acta Chemica Scandinavica, 1971, 25, 3337-3346 |
9016197 | CIF | O6 P Rb V | P b c a | 6.8182; 9.291; 17.631 90; 90; 90 | 1116.89 | Amoros, P.; Beltran-Porter D; Le Bail, A.; Ferey, G.; Villeneuve, G. Crystal structure of A(VO2)(HPO4)(A=NH4,K,Rb) solved from X-ray powder diffraction _cod_database_code 1000081 European Journal of Solid State and Inorganic Chemistry, 1988, 25, 599-607 |
9016263 | CIF | Ba Be F O4 P | F 1 | 6.889; 16.814; 6.902 90.01; 89.99; 90.32 | 799.458 | Simonov, M. A.; Egorov-Tismenko Y K; Belov, N. V. Use of modern X-ray equipment to solve fine problems of structural mineralogy by the example of the crystal structure of babefphite BaBe(PO4)F Soviet Physics Crystallography, 1980, 25, 28-31 |
9016662 | CIF | Ag4 Mn S6 Sb2 | P 1 21/n 1 | 10.31; 8.07; 6.62 90; 92.68; 90 | 550.193 | Hruskova, J.; Synecek, V. The crystal structure of samsonite, 2 Ag2S*MnS*Sb2S3 Acta Crystallographica, Section B, 1969, 25, 1004-1006 |
9017211 | CIF | Al0.824 Ca3 Fe1.176 O8 Ti | P m m a | 5.42; 11.064; 5.5383 90; 90; 90 | 332.115 | Sharygin, V. V.; Lazic, B.; Armbruster, T. M.; Murashko, M. N.; Wirth, R.; Galuskina, I. O.; Galuskin, E. V.; Vapnik, Y.; Britvin, S. N.; Logvinova, A. M. Shulamitite Ca3TiFe3+AlO8 - a new perovskite-related mineral from Hatrurim Basin, Israel European Journal of Mineralogy, 2013, 25, 97-111 |
9017212 | CIF | Ba O24 Si7 Yb6 | P 1 21/m 1 | 5.5173; 27.26; 6.815 90; 106.73; 90 | 981.601 | Wierzbicka-Wieczorek M; Kolitsch, U. BaYb6(Si2O7)2(Si3O10) - the first silicate containing both Si2O7 and Si3O10 groups: synthesis, crystal chemistry and topology European Journal of Mineralogy, 2013, 25, 509-517 |
9017213 | CIF | Al Cs0.02 K0.83 Na0.15 O8 Si3 | C 1 2/m 1 | 8.5497; 13.0216; 7.1843 90; 115.988; 90 | 718.959 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: Sample H002 European Journal of Mineralogy, 2013, 25, 597-614 |
9017214 | CIF | Al K0.93 Na0.07 O8 Si3 | C 1 2/m 1 | 8.5739; 12.9874; 7.2018 90; 116.042; 90 | 720.521 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: Sample H003 European Journal of Mineralogy, 2013, 25, 597-614 |
9017215 | CIF | Al K0.92 Na0.08 O8 Si3 | C 1 2/m 1 | 8.5739; 12.9874; 7.2018 90; 116.042; 90 | 720.521 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: Gemini RT Data, Sample H003 European Journal of Mineralogy, 2013, 25, 597-614 |
9017216 | CIF | Al K0.92 Na0.08 O8 Si3 | C 1 2/m 1 | 8.575; 12.984; 7.2008 90; 116.028; 90 | 720.41 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: T = 293 K, Sample H003_RTend European Journal of Mineralogy, 2013, 25, 597-614 |
9017217 | CIF | Al K0.92 Na0.08 O8 Si3 | C 1 2/m 1 | 8.5752; 12.986; 7.2013 90; 116.023; 90 | 720.619 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: T = 293 K, Sample H003_RT European Journal of Mineralogy, 2013, 25, 597-614 |
9017218 | CIF | Al K0.92 Na0.08 O8 Si3 | C 1 2/m 1 | 8.6159; 12.9806; 7.1991 90; 115.956; 90 | 723.93 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: T = 600 K, Sample H003 European Journal of Mineralogy, 2013, 25, 597-614 |
9017219 | CIF | Al K0.92 Na0.08 O8 Si3 | C 1 2/m 1 | 8.6609; 12.977; 7.2003 90; 115.876; 90 | 728.124 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: T = 900 K, Sample H003 European Journal of Mineralogy, 2013, 25, 597-614 |
9017220 | CIF | Al K0.92 Na0.08 O8 Si3 | C 1 2/m 1 | 8.6849; 12.9747; 7.203 90; 115.819; 90 | 730.638 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: T = 1075 K, Sample H003 European Journal of Mineralogy, 2013, 25, 597-614 |
9017221 | CIF | Al1.04 Ba0.02 K0.4 Na0.58 O8 Si2.96 | C 1 2/m 1 | 8.3463; 12.9877; 7.1683 90; 116.18; 90 | 697.324 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: Sample San40, cation-exchanged sanidine European Journal of Mineralogy, 2013, 25, 597-614 |
9017222 | CIF | Al Ba0.02 K0.98 O8 Si3 | C 1 2/m 1 | 8.6032; 13.0237; 7.1885 90; 115.994; 90 | 723.961 | Angel, R. J.; Ross, N. L.; Zhao, J.; Sochalski-Kolbus L; Kruger, H.; Schmidt, B. C. Structural controls on the anisotropy of tetrahedral frameworks: the example of monoclinic feldspars Note: Sample San100 European Journal of Mineralogy, 2013, 25, 597-614 |
9017223 | CIF | Al3.1 Ca2.5 Cl1.9 F2.1 Fe0.3 K6.5 Mg0.1 Na1.6 O29 Si9.6 | P m m n :2 | 7.0618; 38.42; 6.5734 90; 90; 90 | 1783.46 | Sharygin, V. V.; Pekov, I. V.; Zubkova, N. V.; Khomyakov, A. P.; Stoppa, F.; Pushcharovsky, D. Y. Umbrianite, K7Na2Ca2[Al3Si10O29]F2Cl2, a new mineral species from melilitolite of the Pian di Celle volcano, Umbria, Italy European Journal of Mineralogy, 2013, 25, 655-669 |
9017224 | CIF | Al0.38 As3 Ca0.73 Cu0.4 Fe0.9 K0.3 Mn0.13 Na1.69 O12 Zn0.32 | C 1 2/c 1 | 12.64; 13.007; 6.7 90; 113.828; 90 | 1007.64 | Krivovichev, S. V.; Vergasova, L. P.; Filatov, S. K.; rybin D S; Britvin, S. N.; Ananiev, V. V. Hatertite, Na2(Ca,Na)(Fe3+,Cu)2(AsO4)3, a new alluaudite-group mineral from Tolbachik fumaroles, Kamchatka peninsula, Russia European Journal of Mineralogy, 2013, 25, 683-691 |
9017225 | CIF | As Cu5 H8 O15 | P m n 21 | 3.0113; 14.259; 14.932 90; 90; 90 | 641.152 | Mills, S. J.; Kampf, A. R.; McDonald, A. M.; Bindi, L.; Christy, A. G.; Kolitsch, U.; Favreau, G. The crystal structure of parnauite: a copper arsenate-sulphate with translational disorder of structural rods European Journal of Mineralogy, 2013, 25, 693-704 |
9017226 | CIF | As0.5 Cu2.5 H2.15 O6.575 | P m n 21 | 3.0088; 14.212; 14.89 90; 90; 90 | 636.712 | Mills, S. J.; Kampf, A. R.; McDonald, A. M.; Bindi, L.; Christy, A. G.; Kolitsch, U.; Favreau, G. The crystal structure of parnauite: a copper arsenate-sulphate with translational disorder of structural rods European Journal of Mineralogy, 2013, 25, 693-704 |
9017227 | CIF | As Cu4.5 O15.25 S0.5 | P 1 1 21 | 6.02; 13.99; 15.42 90; 90; 90.01 | 1298.67 | Mills, S. J.; Kampf, A. R.; McDonald, A. M.; Bindi, L.; Christy, A. G.; Kolitsch, U.; Favreau, G. The crystal structure of parnauite: a copper arsenate-sulphate with translational disorder of structural rods Note: theoretical data European Journal of Mineralogy, 2013, 25, 693-704 |
9017228 | CIF | Ba0.5 Cu O10 Si4 Sr0.5 | P 4/n c c :2 | 7.2958; 7.2958; 15.396 90; 90; 90 | 819.509 | Knight, K. S.; Marshall, W. G.; Henderson, C. M. B.; Chamberlain, A. A. Equation of state and a high-pressure structural phase transition in the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Note: P = 4.13 GPa European Journal of Mineralogy, 2013, 25, 909-917 |
9017229 | CIF | Ba0.5 Cu O10 Si4 Sr0.5 | P 4 21 2 (a-1/4,b+1/4,c) | 7.2623; 7.2623; 15.252 90; 90; 90 | 804.406 | Knight, K. S.; Marshall, W. G.; Henderson, C. M. B.; Chamberlain, A. A. Equation of state and a high-pressure structural phase transition in the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Note: P = 4.77 GPa European Journal of Mineralogy, 2013, 25, 909-917 |
9017230 | CIF | Pb5.38 S15.5 Sb6.62 | P -1 | 4.1192; 17.4167; 19.1664 96.127; 90.015; 91.229 | 1366.88 | Orlandi, P.; Biagioni, C.; Moelo, Y.; Bonaccorsi, E. Lead-antimony sulfosalts from Tuscany (Italy). XIV. Disulfodadsonite, Pb11Sb13S30(S2)0.5, a new mineral from the Ceragiola marble quarry, Apuan Alps: occurrence and crystal structure European Journal of Mineralogy, 2013, 25, 1005-1016 |
9017913 | CIF | Fe H7 O8 S | P -1 | 8.935; 11.631; 6.661 95.58; 90.28; 97.28 | 683.293 | Giacovazzo, C.; Menchetti, S. Sulla struttura della amarantite Rendiconti della Societa Italiana di Mineralogia e Petrologia, 1969, 25, 399-406 |
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