@article{CTT100926102, author = {H. Koiso and S. Yoshida and T. Nagai and T. Isobe and A. Nakajima and Y. Mochizuki}, title = {Thermal expansion and phase stability of BF3 (B = Sc, Y, La, Al, Ga, In) from first principles}, journal = {Physical Review B}, year = 2024, } @article{CTT100908338, author = {Y. Mochizuki and H. Koiso and K. Nagamatsu and S. Bae and T. Isobe and A. Nakajima}, title = {Thermal Properties of the Element and Binary Oxides toward Negative Thermal Expansion: A First-Principles Lattice-Dynamics Study}, journal = {The Journal of Physical Chemistry C}, year = 2024, } @article{CTT100908339, author = {Y. Mochizuki and K. Nagamatsu and H. Koiso and T. Isobe and A. Nakajima}, title = {Mechanism of Negative Thermal Expansion in Monoclinic Cu2P2O7 from First Principles}, journal = {The Journal of Physical Chemistry Letters}, year = 2024, } @inproceedings{CTT100926122, author = {Y. Mochizuki and H. Koiso and K. Nagamatsu and S. Bae and T. Isobe and A. Nakajima}, title = {First-Principles Lattice Dynamics Study for Thermal Properties of the Element and Binary Oxides toward Negative Thermal Expansion}, booktitle = {}, year = 2024, } @inproceedings{CTT100926124, author = {H. Koiso and S. Yoshida and T. Nagai and T. Isobe and A. Nakajima and Y. Mochizuki}, title = {Thermal Expansion and Phase Stability of Cubic B(III)F3 (B=Sc, Y, La, Al, In, Ga)}, booktitle = {}, year = 2024, } @inproceedings{CTT100908001, author = {永松 楓 and 望月 泰英 and 小磯 宏喜 and 磯部 敏宏 and 中島 章}, title = {第一原理格子動力学計算に基づく単斜晶系Cu2P2O7における負熱膨張挙動の機構解析}, booktitle = {}, year = 2024, } @inproceedings{CTT100907436, author = {Hiroki Koiso and Yasuhide Mochizuki and Suguru Yoshida and Takayuki Nagai and Toshihiro Isobe and Akira Nakajima}, title = {Thermal Expansion and Polymorphism of B(III)F3: A First-Principles Study}, booktitle = {}, year = 2023, } @inproceedings{CTT100907431, author = {Kaede Nagamatsu and *Yasuhide Mochizuki and Hiroki Koiso and Toshihiro Isobe and Akira Nakajima}, title = {Mechanism of Negative Thermal Expansion in Monoclinic Cu2P2O7: A First-Principles Lattice-Dynamics Study}, booktitle = {}, year = 2023, } @inproceedings{CTT100907432, author = {永松 楓 and 望月 泰英 and 小磯 宏喜 and 磯部 敏宏 and 中島 章}, title = {第一原理計算に基づく単斜晶系Cu2P2O7における負熱膨張挙動の機構解析}, booktitle = {}, year = 2023, } @inproceedings{CTT100907262, author = {小磯 宏喜 and 望月 泰英 and 吉田 傑 and 永井 隆之 and 磯部 敏宏 and 中島 章}, title = {第一原理計算に基づくB(III)F3における熱膨張挙動と結晶多形の解析}, booktitle = {}, year = 2023, } @inproceedings{CTT100904770, author = {永松 楓 and 望月 泰英 and 小磯 宏喜 and 磯部 敏宏 and 中島 章}, title = {第一原理格子動力学計算に基づく単斜晶系負熱膨張材料Cu2P2O7の機構解析}, booktitle = {}, year = 2023, } @inproceedings{CTT100904769, author = {小磯 宏喜 and 望月 泰英 and 磯部 敏宏 and 中島 章}, title = {有限温度における第一原理格子動力学に基づく立方晶SrTiO3の熱膨張性の解析}, booktitle = {}, year = 2023, } @inproceedings{CTT100886871, author = {小磯 宏喜 and 望月 泰英 and 磯部 敏宏 and 松下 祥子 and 中島 章}, title = {第一原理格子動力学計算による二元系フッ化物BF3の構造安定性と熱膨張特性の解析}, booktitle = {}, year = 2023, }