数据_全局_pd块id2015-08-07T11:30 | OTL110213ESRF53__030 | Oliver_T_Lord |整体_audit_creation_method“使用GSAS2CIF从EXP文件”_审计_创建_日期2015-08-07T11:30_audit_author_name“Oliver T Lord”_审核更新记录; 2015年8月7日T11:30 GSAS2CIF创建的初始CIF;#=============================================================================#该信息描述了CIF的项目、文件等##《水晶学报》。生成C部分论文和编辑信函##根据本节中的信息## ##Rietveld精炼（Acta Cryst.C）CIF提交表##1998年12月14日版本##=============================================================================# 1. 提交详细信息_publ_contact_author_name？#通信作者姓名_publ_contact_author_address#通信作者的地址; ?;_publ_contact_author_email？_publ_contact_author_fax？_publ_contact_author_phone？_publ_contact_letter（公共_联系人_字母）; ?;_发布请求日志？_publ_requested_codector_name？_publ_requested_category？#发布请求类别C辑：CI/CM/CO/FI/FM/FO之一#==============================================================================# 2. 处理摘要（IUCr仅供办公室使用）_日志数据验证编号？_日志日期电子版？_日志日期是否为协同编辑者？_日志日期来自编辑器？_是否接受日记日期？_日志日期打印机首个？_日志日期打印机最终版本？_日志日期是否为屋顶？_日志日期_屋顶_入口？_日志编辑器名称？_日志编辑代码？_日志编辑器注释; ?;_日志编辑者代码？_日志编辑者注释; ?;_journal_coden_ASTM？_日志名称是否完整？_日记年份？_日志卷？_期刊发行？_日志页面第一个？_日志页面最后一个？_日志纸张类别？_journal_suppl_publ_number？_日志供应子页面？#==============================================================================# 3. 标题和作者列表_公共_部分_标题; ?;_公共_部分_标题_脚注; ?;#下面的循环结构应该包含所有#作者，按要求的出版顺序。必要时重复上述步骤。回路__公共作者名称_公共_作者_脚注_公共_作者_地址? #<--'姓氏，名字'; ?;; ?;#==============================================================================# 4. 文本_公共_部分_摘要; ?;_公共_部分_摘要; ?;_公共部门_意见; ?;_publ_section_exptl_prep#样品制备的详细信息#应该在这里给出。; ?;_发布_部分_导出_定义; ?;_publ_section_参考; ?;_发布_部分_配置_标签; ?;_发布_部分_确认; ?;数据_OTL110213ESRF53__030_publ#=============================================================================# 5. 整体精炼和计算细节_细化特殊细节; ?;_pd_proc_ls_special_details; ?;#以下项目用于识别所使用的程序。_计算机程序图形？_computing_publication_material？_细化权重方案？_细化ls_weighting_details？_精炼氢化物处理？_细化ls_extinction_method？_refine_ls_extinction_cef？_细化_数量_约束？_refine_ls_restrained_S_all？_refine_ls_restrained_S_obs？#==============================================================================# 6. 样品制备数据#（在一个单独的样品中使用多个样品的特殊情况下#Rietveld研究，应将此信息转移到该阶段#块）#以下三个字段描述了材料的准备。#冷却速度以K/min为单位#制备单位为kPa。制备温度以K为单位。_pd_prep_col_rate？_pd_prep_pressure？_pd_prep_温度？_pd字符颜色？#使用ICDD颜色描述data_OTL110213ESRF53__030_全部_细化_ls_shift/su_max 0.07_细化_ls_shift/su平均值0.02_计算_结构_定义GSAS_细化_ls_number_parameters 5_细化_ls_goodness_of_fit_all 0.41_细化_ls_number_restraints 0_refine_ls_matrix_type已满#指向相位块的指针循环_pd_phase_block_id2015-08-07T11:30 | OTL110213ESRF53__030_phase1 |奥利弗_T_Lord||2015-08-07T11:30 | OTL110213ESRF53__030_phase2 |奥利弗_T_Lord||#衍射图案指针循环_pd_block_diffractogram_id2015-08-07T11:30 | OTL110213ESRF53__030_H_01 |奥利弗_T_Lord | ID27_ESRF#第1阶段信息数据_OTL110213ESRF53__030_phase_1_pd块id2015-08-07T11:30 | OTL110213ESRF53__030_phase1 |奥利弗_T_Lord||#==============================================================================# 7. 化学、结构和结晶数据_pd_char_particle_morphology？_化学名称系统的; ?;_化学名称通用？_化学配方？_化学配方结构？_化学公式分析？_化学熔点？_化学成分来源？#矿物和#天然产物_symmetry_space_group_name_Hall？_exptl_crystal_F_000？_exptl晶体密度衍射？_exptl晶体密度测量？_exptl晶体密度方法？_单元格_测量_温度？_单元格_特殊_详细信息; ?;_geom_special_details？#以下项目标识了所使用的程序（如果适用）。_计算结构解决方案？#==============================================================================# 8. 来自GSAS的相位信息_pd_phase_name“B31镍硅”_单元格长度a 5.1700（6）_单元格长度b 3.3406（5）_单元格长度c 5.6115（8）_单元格角度α90.0_单元格_单元格_贝塔90.0_单元格角度伽马90.0_单元格_卷96.992（13）_对称单元设置正交_symmetry_space_组名_H-M“P n M a”循环对称对称对称对称站点id对称对称对称1+x、+y、+z2-x+1/2，+y+1/2，+z+1/23+x，-y+1/2，+z4-x+1/2，-y，+z+1/2-1-x、-y、-z-2+x+1/2，-y+1/2，-z+1/2-3-x，+y+1/2，-z-4+x+1/2、+y、-z+1/2#原子坐标和位移参数回路__原子站点类型符号_原子站点标签_原子_位_分形__原子站点分形_原子站点分数z_原子站点占用_原子_站点_热_置换_类型_原子_站点_U_iso_or_equiv_atom_site_symmetry_多重性镍镍0.00779 0.25 0.18752 1.0 Uiso 0.015 4硅硅0.32128 0.75 0.0825 1.0 Uiso 0.015 4loop_atom_type_symbol循环_原子类型编号单元格镍4.0硅4.0#如果更改Z，请确保更改以下三项_化学式“Ni-Si”_化学配方重量86.79_单元格_公式_单位_Z 4#分子几何学回路__地理绑定原子站点标签1_地理绑定原子站点标签2_地理绑定距离_地理绑定站点对称1_地理绑定站点对称2_geom_bond_publ标志镍镍合金2.68802（29）-1_5 55牛顿镍镍合金2.68802（29）-1_5 65牛顿Ni1 Ni1 2.67842（31）-2_4 55牛顿Ni1 Ni1 2.67842（31）-2_5 55牛顿Ni1 Si1 2.40083（22）。1_5 45牛顿Ni1 Si1 2.40083（22）。1_5 55牛顿镍硅合金2.38610（30）。2_5 45牛顿镍硅合金2.27821（21）-1_5 65牛顿Ni1 Si1 2.32059（22）-2_4 55个Ni1 Si1 2.32059（22）-2_4 65牛顿Si1 Ni1 2.40083（22）。1_5 55牛顿Si1 Ni1 2.40083（22）。1_5 65牛顿硅镍合金2.38610（30）。2_5 54牛顿Si1 Ni1 2.27821（21）-1_5 65牛顿Si1 Ni1 2.32059（22）-2_5 55牛顿Si1 Ni1 2.32059（22）-2_5 65牛顿Si1 Si1 2.65747（23）-1_6 65牛顿Si1 Si1 2.65747（23）-1_6 75牛顿回路__地理角度原子站点标签1_地理角度原子站点标签2_地理角度_高程_高程_标签_3_地理角度_地理角度场地对称1_地理角度场地对称2_地理角度场地对称3_地理角度ubl标志Si1 Ni1 Si1 88.169（11）1_545。1_5 55牛顿Si1 Ni1 Si1 88.739（5）1_545。2_5 45牛顿Si1 Ni1 Si1 109.930（7）1_545-1_5 65牛顿Si1 Ni1 Si1 85.196（9）1_545-2_5 56牛顿Si1 Ni1 Si1 156.6026（23）1_545-2_5 66牛Si1 Ni1 Si1 88.739（5）1_555。2_5 45个Si1 Ni1 Si1 109.930（7）1_555-1_5 65牛顿Si1 Ni1 Si1 156.6026（23）1_555-2_5 56牛顿Si1 Ni1 Si1 85.196（9）1_555-2_5 66牛Si1-Ni1-Si1 153.4267（17）2_545中所述-1_5 65牛顿Si1 Ni1 Si1 68.735（7）2_545-2_5 56牛顿Si1 Ni1 Si1 68.735（7）2_545-2_5 66牛Si1 Ni1 Si1 93.415（7）-1_565-2_5 56牛顿Si1 Ni1 Si1 93.415（7）-1_565-2_5 66牛Si1 Ni1 Si1 92.071（11）-2_556-2_5 66个Ni1 Si1 Ni1 88.169（11）1_555。1_5 65牛顿Ni1 Si1 Ni1 118.5566（29）1_555。2_5 54牛顿Ni1 Si1 Ni1 70.070（7）1_555-1_5 65牛顿Ni1 Si1 Ni1 69.099（9）1_555-2_5 55牛顿Ni1 Si1 Ni1 130.148（7）1_555-2_5 65牛顿Ni1 Si1 Ni1 118.5566（29）1_565。2_5 54牛顿Ni1 Si1 Ni1 70.070（7）1_565-1_5 65牛顿Ni1 Si1 Ni1 130.148（7）1_565-2_5 55牛顿Ni1 Si1 Ni1 69.099（9）1_565-2_5 65牛顿Ni1 Si1 Ni1 70.049（9）2_554-1_5 65个Ni1 Si1 Ni1 111.265（7）2_554-2_5 55牛顿Ni1 Si1 Ni1 111.265（7）2_554-2_5 65牛顿Ni1 Si1 Ni1 132.857（5）-1_565-2_5 55牛顿Ni1 Si1 Ni1 132.857（5）-1_565-2_5 65牛顿Ni1 Si1 Ni1 92.071（11）-2_555-2_5 65牛顿#第2阶段信息数据_OTL110213ESRF53__030_phase_2_pd块id2015-08-07T11:30 | OTL110213ESRF53__030_phase2 |奥利弗_T_Lord||#第2阶段柱状图循环_pd_block_diffractogram_id2015-08-07T11:30 | OTL110213ESRF53__030_H_01 |奥利弗_T_Lord | ID27_ESRF#==============================================================================# 7. 化学、结构和结晶数据_pd_char_particle_morphology？_化学名称系统的; ?;_化学名称通用？_化学配方？_化学配方结构？_化学公式分析？_化学熔点？_化学成分来源？#矿物和#天然产物_symmetry_space_group_name_Hall？_exptl_crystal_F_000？_exptl晶体密度衍射？_exptl晶体密度测量？_exptl晶体密度方法？_单元格_测量_温度？_单元格_特殊_详细信息; ?;_geom_special_details？#以下项目标识了所使用的程序（如果适用）。_计算结构解决方案？#==============================================================================# 8. 来自GSAS的相位信息_pd_phase_name“B20镍硅”_单元格长度a 4.49127（10）_单元格长度b 4.49127_单元格长度c 4.49127_单元格角度α90.0_单元格_角度_贝塔90.0_单元格角度伽马90.0_单元格_音量90.595（6）_symmetry_cell_setting立方_symmetry_space_group_name_H-M“P 21 3”循环对称对称对称对称站点id对称对称对称1+x、+y、+z2+z、+x、+y3+y、+z、+x4+x+1/2，-y+1/2，-z5-z，+x+1/2，-y+1/26-y+1/2，-z，+x+1/27-z+1/2，-x，+y+1/28+y+1/2，-z+1/2，-x9-y，+z+1/2，-x+1/210-x+1/2，-y，+z+1/211+z+1/2，-x+1/2，-y12-x，+y+1/2，-z+1/2#原子坐标和位移参数回路__原子站点类型符号_原子站点标签_原子_位_分形__原子站点分形_原子站点分数z_原子站点占用_原子_站点_热_置换_类型_原子_站点_U_iso_or_equiv_atom_site_symmetry_多重性镍NI1 0.1359 0.1359 0.1 359 1.0 Uiso 0.01 4硅SI2 0.8419 0.8419 0.9419 1.0 Uiso 0.01 4循环自动类型符号_原子类型编号单元格镍4.0硅4.0#如果更改Z，请确保更改以下所有3项_化学式“Ni-Si”_化学配方重量86.79_单元格_公式_单位_Z 4#分子几何学回路__地理绑定原子站点标签1_地理绑定原子站点标签2_地理绑定距离_地理绑定站点对称1_地理绑定站点对称2_geom_bond_publ标志NI1 NI1 2.75381（5）。4_4 55个NI1 NI1 2.75381（5）。4_5 55牛顿NI1 NI1 2.75381（5）。5_5 45牛顿NI1 NI1 2.75381（5）。5_5 55牛顿NI1 NI1 2.75381（5）。6_5 54牛顿NI1 NI1 2.75381（5）。6_5 55牛顿NI1 SI2 2.28706（4）。1_4 44牛顿NI1 SI2 2.33900（5）。4_4 56牛顿NI1 SI2 2.52320（6）。4_4 66牛NI1 SI2 2.33900（4）。5_6 45牛顿NI1 SI2 2.52320（5）。5_6 46牛顿NI1 SI2 2.33900（4）。6_5 64牛顿NI1 SI2 2.52320（5）。6_6 64牛顿SI2 NI1 2.28706（4）。1_6 66牛SI2 NI1 2.33900（5）。4_5 56牛顿SI2 NI1 2.52320（6）。4_5 66牛SI2 NI1 2.33900（4）。5_6 55牛顿SI2 NI1 2.52320（5）。5_6 56牛顿SI2 NI1 2.33900（4）。6_5 65牛顿SI2 NI1 2.52320（5）。6_6 65个SI2 SI2 2.78228（5）。4_4 67牛顿SI2 SI2 2.78228（5）。4_5 67牛顿SI2 SI2 2.78228（6）。5_7 46牛顿SI2 SI2 2.78228（6）。5_7 56牛顿SI2 SI2 2.78228（5）。6_6 74牛顿SI2 SI2 2.78228（5）。6_6 75牛顿回路__地理角度原子站点标签1_地理角度原子站点标签2_地理角度_高程_高程_标签_3_地理角度_地理角度场地对称1_地理角度场地对称2_地理角度场地对称3_地理角度ubl标志SI2 NI1 SI2 73.93620（30）1_444。4_4 56牛顿SI2 NI1 SI2 140.4588（6）1_444。4_4 66牛SI2 NI1 SI2 73.9362（14）1_444。5_6 45牛顿SI2 NI1 SI2 140.4588（4）1_444。5_6 46牛顿SI2 NI1 SI2 73.9362（11）1_444。6_5 64牛顿SI2 NI1 SI2 140.45880（20）1_444。6_6 64牛顿SI2 NI1 SI2 134.9149 4_456。4_4 66牛SI2 NI1 SI2 112.6530（5）4_456。5_6 45牛顿SI2 NI1 SI2 106.3292（6）4_456。5_6 46个SI2 NI1 SI2 112.65300（20）4_456。6_5 64牛顿SI2 NI1 SI2 69.6932 4_456。6_6 64牛顿SI2 NI1 SI2 69.6932（7）4_466。5_6 45牛顿SI2 NI1 SI2 66.9179（5）4_466。5_6 46牛顿SI2 NI1 SI2 106.32920（10）4_466。6_5 64牛顿SI2 NI1 SI2 66.9179 4_466。6_6 64牛顿SI2 NI1 SI2 134.9149（13）5_645。5_6 46牛顿SI2 NI1 SI2 112.6530（7）5_645。6_5 64牛顿SI2 NI1 SI2 106.3292（7）5_645。6_6 64个SI2 NI1 SI2 69.6932（7）5_646。6_5 64牛顿SI2 NI1 SI2 66.9179（6）5_646。6_6 64牛顿SI2 NI1 SI2 134.9149（13）6_564。6_6 64牛顿NI1 SI2 NI1 137.1767（8）1_666。4_5 56牛顿NI1 SI2 NI1 69.64930（10）1_666。4_5 66牛NI1 SI2 NI1 137.1767（5）1_666。5_6 55牛顿NI1 SI2 NI1 69.6493（13）1_666。5_6 56牛顿NI1 SI2 NI1 137.17670（30）1_666。6_5 65牛顿NI1 SI2 NI1 69.6493（11）1_666。6_6 65牛顿NI1 SI2 NI1 134.9149 4_556。4_5 66个NI1 SI2 NI1 72.1256（6）4_556。5_6 55牛顿NI1 SI2 NI1 68.8752（5）4_556。5_6 56牛顿NI1 SI2 NI1 72.12560（20）4_556。6_5 65牛顿NI1 SI2 NI1 114.80650（10）4_556。6_6 65牛顿NI1 SI2 NI1 114.8065（6）4_566。5_6 55牛顿NI1 SI2 NI1 108.5776（7）4_566。5_6 56牛顿NI1 SI2 NI1 68.87520（20）4_566。6_5 65牛顿NI1 SI2 NI1 108.5776 4_566。6_6 65牛顿NI1 SI2 NI1 134.9149（13）5_655。5_6 56个NI1 SI2 NI1 72.1256（8）5_655。6_5 65牛顿NI1 SI2 NI1 68.8752（6）5_655。6_6 65牛顿NI1 SI2 NI1 114.8065（6）5_656。6_5 65牛顿NI1 SI2 NI1 108.5776（7）5_656。6_6 65牛顿NI1 SI2 NI1 134.9149（13）6_565。6_6 65牛顿#直方图1的粉末衍射数据数据_OTL110213ESRF53__030_p_01_pd块id2015-08-07T11:30 | OTL110213ESRF53__030_H_01 |奥利弗_T_Lord | ID27_ESRF#==============================================================================# 9. 仪器特性_exptl特殊详细信息; ?;#如果排除了数据区域，则在此处提供原因：_pd_proc_info_excluded_regions区域; ?;#以下项目用于识别用于记录的设备#在实验室测量衍射图时的粉末图案#而不是作者的家庭机构，例如当中子或同步加速器#使用辐射。_pd_instr_位置; ?;_pd_calibration_special_details#所用方法的描述#校准仪器; ?;_衍射环境温度？_衍射源？_衍射源目标？_衍射源类型？_衍射测量设备类型？_衍射检测器？_衍射检测器类型？#探测器的品牌或型号_pd_meas_scan方法？#选项包括“step”、“cont”、，#“tof”、“fixed”或#“disp”（=分散）_产品数据表特殊详细信息; ?;#以下两项确定了所使用的程序（如果适用）。_计算数据收集？_计算数据还原？#描述在细化之前对数据执行的任何处理。#例如：手动Lp校正或预计算吸收校正_pd_proc_info_data_reduction？#以下项目仅用于角度色散测量。_衍射辐射单色仪？#以下项目用于定义仪器的大小。#并非所有距离都适用于所有仪器类型。_pd_instr_dist_src/mono？_pd_instr_dist_mono/spec？_pd_instr_dist_src/spec？_pd_instr_dist_spec/anal？_pd_instr_dist_anal/detc？_pd_instr_dist_spec/detc？# 10. 试样尺寸和安装信息#接下来的三个字段以mm为单位给出了样本尺寸。赤道#平面包含入射光束和衍射光束。_pd_spec_size_axi轴？#垂直于#赤道面_pd_spec_size_equat？编号平行于#散射矢量#在变速箱中_pd规格尺寸厚度？#平行于#散射矢量#在反思中_pd_spec_mounting#此字段应为#用于提供#容器。; ?;_pd_spec安装模式？#选项是“反射”#或“传输”_pd规格形状？#选项为“圆柱体”#“flat_sheet”或“unregular”#相位表循环_pd_phase_id_pd相位块id_pd_相位_质量_%_pd_proc_ls_profile_函数_pd_proc_ls_peak_cutoff2 2015-08-07T11:30 | OTL110213ESRF53__030_phase2 |奥利弗_T_Lord||?;CW配置文件功能编号2，具有18个术语伪voigt函数Simpson规则积分的轮廓系数C.J.Howard（1982）。J.应用。克里斯特。，15,615-620.P.Thompson、D.E.Cox和J.B.Hastings（1987年）。J.应用。克里斯特。，20,79-83.#1（GU）=1.000#2（GV）=287.975#3（GW）=-5.212#4（LX）=1.738#5（LY）=0.000#6（trns）=0.000#7（asym）=0.0000#8（shft）=0.0000#9（GP）=0.000#10（stec）=0.00#11（ptec）=0.00#12（sfec）=0.00#13（L11）=0.000#14（L22）=0.000#15（L33）=0.000#16（L12）=0.000#17（L13）=0.000#18（L23）=0.000如果强度低于峰值的0.0100倍，则忽略峰值尾部阿尼索。加宽轴0.0 0.0 1.0;0.01000循环自动类型符号_atom_type_scat_dispersion_real格式_atom_type_scat_dispersion_imag_atom_type_scat_Cromer_Mann_a1型_atom_type_scat_Cromer_Mann_a2型_atom_type_scat_Cromer_Mann_a3原子类型_atom_type_scat_Cromer_Mann_a4型_atom_type_scat_Cromer_Mann_b1_atom_type_scat_Cromer_Mann_b2_atom_type_scat_Cromer_Mann_b3型_原子_类型_类别_计时器_手动_b4_原子_类型_类别_计时器_手动__原子类型类别源镍0.000 0.00012.8376 3.87850 7.29200 0.25650 4.44380 12.1763 2.38000 66.3421 1.03410 国际表格Vol_C硅0.000 0.0006.29150 2.43860 3.03530 32.3337 1.98910 0.67850 1.54100 81.6937 1.14070 国际表格Vol_C_衍射辐射探针x射线_衍射辐射偏振比0.95_衍射辐射波长0.3738_衍射辐射类型？_pd_proc_ls_prof_R_系数0.0096_pd_proc_ls_prof_wR_系数0.0220_pd_proc_ls_prof_wR_预期0.0539_refine_ls_R_Fsqd_factor“”_pd_proc_ls_background_函数; GSAS背景功能编号1，有18个术语。第一类移位切比雪夫函数1: 330.380 2: 76.4576 3: 14.9675 4: -19.4541 5: 14.8023 6: -8.02851 7: 2.99303 8: -1.05193 9: 0.530650 10: 1.07305 11: 0.716837 12: -0.722437 13: -1.19093 14: -0.737144 15: 0.678872 16: 0.983656 17: 0.346147 18: 0.403105 ;_exptl_absorpt_process_details（导出吸收过程详细信息）; GSAS吸收/表面粗糙度校正：功能编号0不进行修正。;_exptl_absorpt_correction_T_最小1.00000_exptl_absorpt_correction_T_最大1.00000#消光校正_gsas_exptl_extinct_corr_T_最小1.00000_gsas_exptl_extinct_corr_T_最大1.00000_pd_proc_info_datetime时间2015-08-07T11:30:09_pd_calc_method“Rietveld精炼”#----原始/计算数据循环-----_pd测量值2θ范围最小值0.00878_pd测量2θ范围最大值35.93125_pd_测量_θ_范围_ inc 0.01757_pd_proc2θ范围最小值0.00878_pd_proc2θ范围最大值35.93125_pd_proc2θ范围_ inc 0.01757回路__pd_数量_总数_pd_岩石_重量_pd_岩石_强度_bkg_calc_pd_成本_强度_总计17.0 0.0 -34615.37109 .17.0 0.0 -33427.93750 .17.0 0.0 -32276.81445 .18.0 0.0 -31161.00000 .19.0 0.0 -30079.51758 .17.0 0.0 -29031.42773 .17.0 0.0 -28015.80273 .17.0 0.0 -27031.72656 .18.0 0.0 -26078.34180 .18.0 0.0 -25154.74805 .18.0 0.0 -24260.15039 .18.0 0.0 -23393.71289 .18.0 0.0 -22554.64844 .19.0 0.0 -21742.16602 .18.0 0.0 -20955.52930 .18.0 0.0 -20193.98438 .18.0 0.0 -19456.82812 .18.0 0.0 -18743.35742 .18.0 0.0 -18052.87500 .18.0 0.0 -17384.73633 .18.0 0.0 -16738.29688 .18.0 0.0 -16112.91797 .18.0 0.0 -15507.98438 .18.0 0.0 -14922.89648 .18.0 0.0 -14357.08398 .18.0 0.0 -13809.96777 .18.0 0.0 -13281.00781 .18.0 0.0 -12769.65820 .18.0 0.0 -12275.39551 .18.0 0.0 -11797.71484 .18.0 0.0 -11336.11914 .18.0 0.0 -10890.12793 .19.0 0.0 -10459.26660 .19.0 0.0 -10043.08105 .18.0 0.0 -9641.12500 .19.0 0.0 -9252.97168 .19.0 0.0 -8878.19238 .19.0 0.0 -8516.38281 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.0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . .0.0 . . ._pd计量点数量2046_pd _岩石_点数2046回路__refln_索引_h_refln_索引_k_refln_索引_l_pd_refln_阶段id_refn_observed_状态_refln_F_平方_面积_refln_F_平方_校准_回流_相位_校准_refln_d间距_gsas_i100个月1 1 0 2 o 230.178 230.178 0.00 3.17580 26.211 1 1 2 o 1974.869 1974.869 0.00 2.59303 100.002 0 0 2 o 17.088 17.088 0.00 2.24563 0.492 0 1 2 o 7.743 7.743 0.00 2.00855 0.352 1 0 2 o 7.743 7.743 0.00 2.00855 0.352 1 1 2 o 821.373 821.373 0.00 1.83355 62.492 2 0 2 o 45.335 45.335 0.00 1.58790 1.292 2 1 2 o 288.693 288.693 0.00 1.49709 14.673 0 1 2 o 2.762 2.762 0.00 1.42026 0.063 1 0 2 o 2.762 2.762 0.00 1.42026 0.063 1 2 o 20.096 20.096 0.00 1.35417 0.842 2 2 o 1195.941 1195.941 0.00 1.29652 15.213 0 2 2 o 0.001 0.001 0.00 1.24565 0.003 2 0 2 o 0.001 0.001 0.00 1.24565 0.003 2 1 2 o 31.157 31.157 0.00 1.20034 1.023 1 2 o 31.168 31.168 0.00 1.20034 1.024 0 0 2 o 23.860 23.860 0.00 1.12282 0.174 0 1 2 o 3.294 3.294 0.00 1.08929 0.043 2 2 o 3.294 3.294 0.00 1.08929 0.094 1 0 2 o 3.294 3.294 0.00 1.08929 0.044 1 1 2 o 40.006 40.006 0.00 1.05860 1.023 3 0 2 o 40.002 40.002 0.00 1.05860 0.513 3 1 2 o 795.762 795.762 0.00 1.03037 19.264 2 0 2 o 11.528 11.528 0.00 1.00428 0.134 0 2 2 o 11.528 11.528 0.00 1.00428 0.134 2 1 2 o 64.150 64.150 0.00 0.98007 1.414 1 2 o 63.767 63.767 0.00 0.98007 1.403 3 2 2 o 466.374 466.379 0.00 0.95754 9.764 2 2 o 8.689 8.689 0.00 0.91678 0.174 0 3 2 o 36.843 36.843 0.00 0.89825 0.344 3 0 2 o 36.876 36.876 0.00 0.89825 0.344 3 1 2 o 49.175 49.175 0.00 0.88081 0.874 1 3 2 o 49.125 49.125 0.00 0.88081 0.875 0 1 2 o 49.121 49.121 0.00 0.88081 0.445 1 0 2 o 49.115 49.115 0.00 0.88081 0.443 3 3 2 o 0.001 0.001 0.00 0.86434 0.005 1 1 2 o 0.001 0.001 0.00 0.86434 0.00_refns_number_total参考号_总计37_回复_限制_小时最小值1_反射_极限_最大值5_reflns_limit_k_min零_回复_限制_k_最大值3_reflns_limit_l_min零_回复限制最大值3_refns_d_resolution_高0.864_回复_解决方案_低3.176#--eof--eof--eof--eof--eof--eof--eof--eof--eof--eof--eof--#