Information card for entry 1565024

Structure parameters

• Common name: Ca2Cu(OH)4[B(OH)4]2
• Mineral name: henmilite
• Formula: B2 Ca2 Cu H12 O12
• Calculated formula: B2 Ca2 Cu H12 O12
• Title of publication: Quantum spin fluctuations and hydrogen bond network in the antiferromagnetic natural mineral henmilite
• Authors of publication: Yamamoto, H.; Sakakura, T.; Jeschke, H.O.; Kabeya, N.; Hayashi, K.; Ishikawa, Y.; Fujii, Y.; Kishimoto, S.; Sagayama, H.; Shigematsu, K.; Azuma, M.; Ochiai, A.; Noda, Y.; Kimura, H.
• Journal of publication: Physical Review Materials
• Year of publication: 2021
• Journal volume: 5
• Pages of publication: 104405-1 - 104405-8
• a: 11.538 ± 0.002 Å
• b: 7.989 ± 0.003 Å
• c: 5.6504 ± 0.0013 Å
• α: 109.68 ± 0.02°
• β: 91.516 ± 0.017°
• γ: 83.71 ± 0.019°
• Cell volume: 487.4 ± 0.2 ų
• Ambient diffraction temperature: 298 K
• Ambient diffracton pressure: 100 kPa
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No