Gibbsite
	Balan E, Lazzeri M, Morin G, Mauri F
	American Mineralogist 91 (2006) 115-119
	First-principles study of the OH-stretching modes of gibbsite
	Locality: hypothetical structure calculated with DFT
	_database_code_amcsd 0003998
	8.742 5.112 9.801 90 94.54 90 P2_1/n
	atom x y z
	Al1 .168 .531 -.003
	Al2 .336 .025 -.003
	O1 .174 .219 -.112
	O2 .669 .655 -.103
	O3 .498 .133 -.106
	O4 -.020 .632 -.108
	O5 .303 .716 -.105
	O6 .822 .146 -.102
	H1 .072 .138 -.123
	H2 .574 .551 -.102
	H3 .494 .108 -.207
	H4 -.049 .817 -.113
	H5 .300 .718 -.206
	H6 .807 .162 -.203
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Gibbsite
	Megaw H
	Zeitschrift fur Kristallographie 87 (1934) 185-204
	The crystal structure of Hydrargillite Al (O H)3
	_cod_database_code 1011081
	_database_code_amcsd 0017978
	8.641 5.070 9.720 90 85.43 90 P2_1/n
	atom x y z
	Al1 .177 .52 -.005
	Al2 .333 .02 -.005
	O1 .182 .202 -.11
	O2 .682 .672 -.11
	O3 .515 .132 -.11
	O4 -.015 .632 -.11
	O5 .298 .702 -.1
	O6 .838 .172 -.1
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Gibbsite
	Saalfeld H, Wedde M
	Zeitschrift fur Kristallographie 139 (1974) 129-135
	Refinement of the crystal structure of gibbsite, Al(OH)3
	Locality: Langesundfjord, Norway
	_database_code_amcsd 0010761
	8.684 5.078 9.736 90 94.54 90 P2_1/n
	atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	Al1 .1679 .5295 -.0023 .0012 .0047 .0023 -.0001 .0005 .0002
	Al2 .3344 .0236 -.0024 .0012 .0048 .0023 .0001 .0004 .0000
	O1 .1779 .2183 -.1115 .0013 .0083 .0029 -.0008 -.0001 -.0003
	O2 .6692 .6558 -.1023 .0012 .0089 .0029 -.0008 .0000 -.0003
	O3 .4984 .1315 -.1044 .0018 .0086 .0024 .0000 .0002 .0005
	O4 -.0205 .6293 -.1068 .0015 .0079 .0030 -.0003 .0002 .0005
	O5 .2971 .7178 -.1052 .0022 .0085 .0024 -.0004 .0005 -.0001
	O6 .8194 .1491 -.1015 .0019 .0082 .0023 -.0002 .0002 -.0002
	H1 .101 .152 -.124 1.
	H2 .595 .573 -.098 1.
	H3 .503 .137 -.190 1.
	H4 -.029 .801 -.107 0.
	H5 .293 .724 -.196 2.
	H6 .815 .160 -.190 1.
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)

Download in: Amc Format Cif Format Diffraction data

Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then clicking

Multiple datasets can be downloaded as individual files inside a ZIP archive by selecting the datasets and then clicking