The density functional theory was employed to investigate the adsorption of Nin (n=1–4) on the perfect and O-defect CuAl2O4 surfaces. The computational results show that for single Ni atom on the perfect spinel (100)...The density functional theory was employed to investigate the adsorption of Nin (n=1–4) on the perfect and O-defect CuAl2O4 surfaces. The computational results show that for single Ni atom on the perfect spinel (100) surface, the adsorption energy is-5.30 eV, much larger than Ni on other CuAl2O4 surfaces. The adsorption of Nin (n=1–4) absorbed on the O-defect CuAl2O4 (100) surface is less stable than on the perfect CuAl2O4 (100) surface. However, the adsorption energy for Nin (n=1–4) on the O-defect CuAl2O4 (110) surface is close to on the perfect CuAl2O4 (110) surface. Bader charge and partial density of states (PDOS) analysis revel that the adsorption of Ni on the CuAl2O4 spinel surface is accompanied by charge transfer from the metal to the support. The growth and aggregations analysis show that the general growth and aggregation ability for Nin clusters follow the order:gas phase>γ-Al2O3 (110)>CuAl2O4 (110)>CuAl2O4 (100). This result can give reasonable explanations for the experimental phenomenon that Ni supported on the CuAl2O4 spinel performs much better stability than on the γ-Al2O3.展开更多
针对核电厂循环水冲洗泵盖板表面结构完整性破坏失效的工程问题,基于冷金属过渡技术(Cold metal transfer,CMT),开展了CuAl9Ni3Fe2铝青铜合金电弧增材修复工艺的研究。通过单层单道成形、单层多道搭接成形以及多层多道试验研究,确定并...针对核电厂循环水冲洗泵盖板表面结构完整性破坏失效的工程问题,基于冷金属过渡技术(Cold metal transfer,CMT),开展了CuAl9Ni3Fe2铝青铜合金电弧增材修复工艺的研究。通过单层单道成形、单层多道搭接成形以及多层多道试验研究,确定并固化了一套CuAl9Ni3Fe2铝青铜合金CMT增材修复工艺的关键参数;并借鉴已有成熟的核电设备制造工程实践,参考RCC-M规范要求,制定了该修复工艺的验证试验要求,明确了试验项目、试验标准及验收指标,并按要求完成试件的制备及试验。结果表明:采用研发的CMT增材修复工艺制备的熔敷金属外观成形优良,内部致密无缺陷且与母材熔合良好,力学性能与母材相当,各项试验结果均满足验收指标。可用于CuAl9Ni3Fe2铝青铜合金的CMT增材制造及修复。展开更多
基金the National Natural Science Foundation of China(Nos. 21763018, 21673270, 21503254 and 21875096)the Natural Science Foundation of jiangxi Province, China(Nos. 20181BAB203016, 20181BCD40004)
文摘The density functional theory was employed to investigate the adsorption of Nin (n=1–4) on the perfect and O-defect CuAl2O4 surfaces. The computational results show that for single Ni atom on the perfect spinel (100) surface, the adsorption energy is-5.30 eV, much larger than Ni on other CuAl2O4 surfaces. The adsorption of Nin (n=1–4) absorbed on the O-defect CuAl2O4 (100) surface is less stable than on the perfect CuAl2O4 (100) surface. However, the adsorption energy for Nin (n=1–4) on the O-defect CuAl2O4 (110) surface is close to on the perfect CuAl2O4 (110) surface. Bader charge and partial density of states (PDOS) analysis revel that the adsorption of Ni on the CuAl2O4 spinel surface is accompanied by charge transfer from the metal to the support. The growth and aggregations analysis show that the general growth and aggregation ability for Nin clusters follow the order:gas phase>γ-Al2O3 (110)>CuAl2O4 (110)>CuAl2O4 (100). This result can give reasonable explanations for the experimental phenomenon that Ni supported on the CuAl2O4 spinel performs much better stability than on the γ-Al2O3.
文摘针对核电厂循环水冲洗泵盖板表面结构完整性破坏失效的工程问题,基于冷金属过渡技术(Cold metal transfer,CMT),开展了CuAl9Ni3Fe2铝青铜合金电弧增材修复工艺的研究。通过单层单道成形、单层多道搭接成形以及多层多道试验研究,确定并固化了一套CuAl9Ni3Fe2铝青铜合金CMT增材修复工艺的关键参数;并借鉴已有成熟的核电设备制造工程实践,参考RCC-M规范要求,制定了该修复工艺的验证试验要求,明确了试验项目、试验标准及验收指标,并按要求完成试件的制备及试验。结果表明:采用研发的CMT增材修复工艺制备的熔敷金属外观成形优良,内部致密无缺陷且与母材熔合良好,力学性能与母材相当,各项试验结果均满足验收指标。可用于CuAl9Ni3Fe2铝青铜合金的CMT增材制造及修复。
