| 查看: 710 | 回复: 2 | ||||
htt11030226新虫 (初入文坛)
|
[求助]
MoC晶体学参数 已有1人参与
|
| 急求MoC晶体学参数，六方的 |
回复此楼» 猜你喜欢
调剂
已经有0人回复
-
【新加坡】纳米电子器件项目组有“联合培养博士生”名额
已经有0人回复
-
物理学I论文润色/翻译怎么收费?
已经有103人回复
-
中德博士后2026项目5月30日截止- 国内博士后入站、德国两年全职
已经有0人回复
-
面向全球申请人的中德博士后2026项目5月30日截止- 国内博后入站德国两年全职
已经有0人回复
-
【新加坡】纳米电子器件项目组有“联合培养博士生”名额
已经有2人回复
-
重庆交大材料学院26年硕士招生复试实施细则已出。欢迎加入光子学微结构与器件课题组。
已经有0人回复
-
北工大宋晓艳教授团队招收2026年9月入学博士【学博和专博名额均有】！
已经有1人回复
-
天津城建大学理学院化学、环境工程、材料物理等方向接收10人
已经有0人回复
-
天津城建大学理学院化学、环境工程、材料物理等方向接收调剂，10人
已经有0人回复
» 本主题相关价值贴推荐，对您同样有帮助:
- 求 ICSD上的晶体结构参数
已经有3人回复
- 求cif文件——MoO2 MoO3 Mo2C MoC
已经有9人回复
- 求助TiO2（021-1272）的晶体学参数
已经有5人回复
- 【求助】紧急求助-Mo2C和MoC的晶体参数
已经有5人回复
月只蓝
主管区长 (职业作家)
-
专家经验: +1059 - 计算强帖: 8
- 应助: 1712 (讲师)
- 贵宾: 8.888
- 金币: 68127.7
- 散金: 1938
- 红花: 443
- 沙发: 4
- 帖子: 4373
- 在线: 3291.4小时
- 虫号: 1122189
- 注册: 2010-10-14
- 专业: 宇宙学
- 管辖: 计算模拟区
【答案】应助回帖
★ ★ ★ ★ ★
感谢参与，应助指数 +1
htt11030226(dbb627代发): 金币+5, 谢谢指导 2014-04-15 15:00:41
感谢参与，应助指数 +1
htt11030226(dbb627代发): 金币+5, 谢谢指导 2014-04-15 15:00:41
|
其一 *data for ICSD #44987 Coll Code 44987 Rec Date 2000/12/16 Mod Date 2007/08/01 Chem Name Molybdenum Carbide (1/1) - Eta, Ht Structured Mo C Sum C1 Mo1 ANX AX D(calc) 9.38 Title Das Dreistoffsystem: Molybdaen-Silizium-Kohlenstoff Author(s) Nowotny, H.;Parthe, E.;Kieffer, R.;Benesovsky, F. Reference Monatshefte fuer Chemie (-108,1977) (1954), 85, 255-272 Planseeberichte fuer Pulvermetallurgie (1962), 10, 42-64 Unit Cell 3.01 3.01 14.61 90. 90. 120. Vol 114.63 Z 6 Space Group P 63/m m c SG Number 194 Cryst Sys hexagonal Pearson hP12 Wyckoff f2 b a Red Cell P 3.01 3.01 14.61 90 90 120 114.634 Trans Red 1.000 0.000 0.000 / 0.000 1.000 0.000 / 0.000 0.000 1.000 Comments M.p. 2923 K (congruent), stable between 1473 and 2923 K AE: Mo1,2: Mo6 C6; C1,2: 6o Mo6 Later corrected to Mo3 C2 Cell from 2nd ref. (Rudy et al.): 3.013, 14.64 The structure has been assigned a PDF number (calculated powder diffraction data): 01-089-4305 The structure has been assigned a PDF number (experimental powder diffraction data): 8-384 Structure type prototype : MoC Structure type : MoC X-ray diffraction (powder) No R value given in the paper. At least one temperature factor missing in the paper. Atom # OX SITE x y z SOF H Mo 1 +4 2 b 0 0 0.25 1. 0 Mo 2 +4 4 f 0.3333 0.6667 0.083 1. 0 C 1 -4 2 a 0 0 0 1. 0 C 2 -4 4 f 0.3333 0.6667 0.667 1. 0 *end for ICSD #44987 其二 *data for ICSD #77156 Coll Code 77156 Rec Date 2003/04/01 Chem Name Molybdenum Carbide (1/1) Structured Mo C Sum C1 Mo1 ANX AX D(calc) 8.68 Title Die Mo C-Phase mit W C-Struktur Author(s) Schuster, J.;Rudy, E.;Nowotny, H. Reference Monatshefte fuer Chemie (-108,1977) (1976), 107, 1167-1176 Nature (London) (1961), 191, 1194-1194 Unit Cell 2.903 2.903 2.828 90. 90. 120. Vol 20.64 Z 1 Space Group P -6 m 2 SG Number 187 Cryst Sys hexagonal Pearson hP2 Wyckoff d a Red Cell P 2.828 2.903 2.903 120 90 90 20.64 Trans Red 0.000 0.000 1.000 / 1.000 0.000 0.000 / 0.000 1.000 0.000 Comments Cell from 2nd reference: 2.898, 2.809 The structure has been assigned a PDF number (calculated powder diffraction data): 01-071-6027 The structure has been assigned a PDF number (experimental powder diffraction data): 45-1015 Structure type : WC X-ray diffraction (powder) No R value given in the paper. At least one temperature factor missing in the paper. Atom # OX SITE x y z SOF H Mo 1 +4 1 a 0 0 0 1. 0 C 1 -4 1 d 0.3333 0.6667 0.5 1. 0 *end for ICSD #77156 其三 *data for ICSD #618298 Coll Code 618298 Rec Date 2008/08/01 Chem Name Molybdenum Carbide (1/1) Structured Mo C Sum C1 Mo1 ANX NO D(calc) 8.78 Title A new molybdenum carbide Author(s) Kuo, K.;Haegg, G. Reference Nature (London) (1952), 170, 245-245 Unit Cell 2.9320 2.9320 10.9700 90.0 90.0 120.0 Vol 81.67 Z 4 Space Group P 63/m m c SG Number 194 Cryst Sys hexagonal Pearson hP8 Wyckoff f d a Red Cell P 2.932 2.932 10.97 90 90 120 81.67 Trans Red 1.000 0.000 0.000 / 0.000 1.000 0.000 / 0.000 0.000 1.000 Comments Structure type : TiAs X-ray diffraction from single crystal \N No R value given in the paper. At least one temperature factor missing in the paper. Atom # OX SITE x y z SOF H C 1 +0 2 a 0 0 0 1.000 0 C 2 +0 2 d 0.3333 0.6667 0.75 1.000 0 Mo 1 +0 4 f 0.3333 0.6667 0.12500 1.000 0 *end for ICSD #618298 其四 *data for ICSD #618300 Coll Code 618300 Rec Date 2008/08/01 Chem Name Molybdenum Carbide (1/1) Structured Mo C Sum C1 Mo1 ANX NO D(calc) 8.77 Title A new phase formed by high pressure treatment: Face centred cubic molybdenum monocarbide Author(s) Clougherty, E.V.;Lothrop, K.H.;Kafalas, J.A. Reference Nature (London) (1961), 191, 1194-1194 Unit Cell 2.898 2.898 2.809 90.0 90.0 120.0 Vol 20.43 Z 1 Space Group P -6 m 2 SG Number 187 Cryst Sys hexagonal Pearson hP2 Wyckoff d a Red Cell P 2.809 2.898 2.898 120 90 90 20.431 Trans Red 0.000 0.000 1.000 / 1.000 0.000 0.000 / 0.000 1.000 0.000 Comments Structure type : WC X-ray diffraction from single crystal \N No R value given in the paper. At least one temperature factor missing in the paper. Atom # OX SITE x y z SOF H C 1 +0 1 d 0.3333 0.6667 0.5 1 0 Mo 1 +0 1 a 0 0 0 1 0 *end for ICSD #618300 |
» 本帖已获得的红花（最新10朵）
htt11030226
2楼2014-04-10 14:36:08
htt11030226
新虫 (初入文坛)
- 应助: 0 (幼儿园)
- 金币: 23.3
- 散金: 40
- 帖子: 47
- 在线: 109小时
- 虫号: 2379248
- 注册: 2013-03-26
- 专业: 理论和计算化学
3楼2014-04-10 21:14:12
5
