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[ Last edited by lizhaozhang on 2009-4-28 at 17:07 ]
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xi2004

ÖÁ×ðľ³æ (Ö°Òµ×÷¼Ò)

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waiy2001(½ð±Ò+1,VIP+0):лл,ÐÁ¿àÁË.... 4-25 13:29
lizhaozhang(½ð±Ò+2,VIP+0):ллÁË~~µ«ÊÇÔõôûÓÐÇâÔ­×ÓµÄλÖ𡣿 4-25 14:36
data_16583-ICSD
#?2008 by Fachinformationszentrum Karlsruhe, and the U.S. Secretary of
#Commerce on behalf of the United States.  All rights reserved.
_database_code_ICSD                16583
_audit_creation_date               1980/01/01
_audit_update_record               1999/06/02
_chemical_name_systematic          'Pentazinc Hexahydroxide Carbonate'
_chemical_formula_structural       'Zn5 (O H)6 (C O3)2'
_chemical_formula_sum              'C2 H6 O12 Zn5'
_chemical_name_mineral             Hydrozincite
_publ_section_title
;
The crystal structure of hydrozincite, Zn6 (O H)6 (C O3)2
;
loop_
_citation_id
_citation_journal_abbrev
_citation_year
_citation_journal_volume
_citation_page_first
_citation_page_last
_citation_journal_id_ASTM
primary 'Acta Crystallographica (1,1948-23,1967)' 1964 17 1051 1057 ACCRA9
_publ_author_name                  'Ghose, S.'
_cell_length_a                     13.62
_cell_length_b                     6.3
_cell_length_c                     5.42
_cell_angle_alpha                  90.
_cell_angle_beta                   95.83
_cell_angle_gamma                  90.
_cell_volume                       462.66
_cell_formula_units_Z              2
_symmetry_space_group_name_H-M     'C 1 2/m 1'
_symmetry_Int_Tables_number        12
_refine_ls_R_factor_all            .16
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
  1        '-x, y, -z'
  2        '-x, -y, -z'
  3        'x, -y, z'
  4        'x, y, z'
  5        '-x+.5, y+.5, -z'
  6        '-x+.5, -y+.5, -z'
  7        'x+.5, -y+.5, z'
  8        'x+.5, y+.5, z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
C4+        4
H1+        1
O2-        -2
Zn2+        2
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_B_iso_or_equiv
Zn1 Zn2+ 2 a 0 0 0 1. 0 0.59
Zn2 Zn2+ 4 h 0 0.263(1) 0.5 1. 0 0.56
Zn3 Zn2+ 4 i 0.1290(3) 0.5 0.038(1) 1. 0 0.67
C1 C4+ 4 i 0.322(4) 0.5 0.309(9) 1. 0 0.9
O1 O2- 4 i 0.421(3) 0.5 0.318(7) 1. 0 0.69
O2 O2- 4 i 0.266(3) 0.5 0.069(7) 1. 0 1.
O3 O2- 4 i 0.275(3) 0.5 0.500(7) 1. 0 0.9
O4 O2- 4 i 0.410(3) 0 0.324(7) 1. 1 0.81
O5 O2- 8 j 0.078(3) 0.245(6) 0.198(7) 1. 1 0.81
#Position of 12 Elements of H Are Undetermined.
#End of data_16583-ICSD
xi2004-emuch@163.com
3Â¥2009-04-24 22:22:19
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lizhaozhang

Òø³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
Originally posted by xi2004 at 2009-4-24 22:22:
data_16583-ICSD
#?2008 by Fachinformationszentrum Karlsruhe, and the U.S. Secretary of
#Commerce on behalf of the United States.  All rights reserved.
_database_code_ICSD                16583
...

лÁ˹þ¡£¡£¡£²»¹ý£¬ÓÐûÓÐÇâÔ­×ÓÈ·¶¨ÁËλÖõİ¡¡£¡£¡£ÎÒÒ²Óнṹ£¬²»¹ýÒ²ÊÇûÓÐÇâµÄλÖá£
4Â¥2009-04-25 14:52:35
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

xi2004

ÖÁ×ðľ³æ (Ö°Òµ×÷¼Ò)

¡ï ¡ï
paopaomeng(½ð±Ò+1,VIP+0):3q 4-25 20:09
lizhaozhang(½ð±Ò+1,VIP+0): 4-26 20:21
È˼ÒûÓж¨°¡, ²»¿ÉÄÜÓÐ.

Äã×Ô¼ºÈç¹ûÊÕÁËÕâ¸öÊý¾Ý, ÄǾÍÊÔÊÔÀíÂÛ¼ÓÇâÁË.
xi2004-emuch@163.com
5Â¥2009-04-25 14:59:13
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

lizhaozhang

Òø³æ (ÕýʽдÊÖ)

ÒýÓûØÌû:
Originally posted by xi2004 at 2009-4-25 14:59:
È˼ÒûÓж¨°¡, ²»¿ÉÄÜÓÐ.

Äã×Ô¼ºÈç¹ûÊÕÁËÕâ¸öÊý¾Ý, ÄǾÍÊÔÊÔÀíÂÛ¼ÓÇâÁË.

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6Â¥2009-04-26 20:22:57
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