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101

Theoretical study of valence photoelectron spectrum of OsO[sub 4]: A spin-orbit RESC-CASPT2 study

Nakajima, Takahito, Koga, Katsumichi, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2000

Language:

english

File:

PDF, 320 KB

english, 2000

102

Fluorescence-lifetime molecular imaging can detect invisible peritoneal ovarian tumors in bloody ascites

Nakajima, Takahito, Sano, Kohei, Sato, Kazuhide, Watanabe, Rira, Harada, Toshiko, Hanaoka, Hirofumi, Choyke, Peter L., Kobayashi, Hisataka

Journal:

Year:

2014

Language:

english

File:

PDF, 2.53 MB

english, 2014

103

Third-order Douglas–Kroll relativistic coupled-cluster theory through connected single, double, triple, and quadruple substitutions: Applications to diatomic and triatomic hydrides

Hirata, So, Yanai, Takeshi, de Jong, Wibe A., Nakajima, Takahito, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 384 KB

english, 2004

104

An ab initio study of excited states of U and UF

Fedorov, Dmitri G., Nakajima, Takahito, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 301 KB

english, 2003

105

Pseudospectral approach to relativistic molecular theory

Nakajima, Takahito, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 336 KB

english, 2004

106

Third-order Douglas–Kroll ab initio model potential for actinide elements

Paulovič, Jozef, Nakajima, Takahito, Hirao, Kimihiko, Seijo, Luis

Journal:

The Journal of Chemical Physics

Year:

2002

Language:

english

File:

PDF, 307 KB

english, 2002

107

A theoretical study of the low-lying states of the AuSi molecule: An assignment of the excited A and D states

Abe, Minori, Nakajima, Takahito, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2002

Language:

english

File:

PDF, 382 KB

english, 2002

108

Accurate relativistic Gaussian basis sets for H through Lr determined by atomic self-consistent field calculations with the third-order Douglas–Kroll approximation

Tsuchiya, Takashi, Abe, Minori, Nakajima, Takahito, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2001

Language:

english

File:

PDF, 330 KB

english, 2001

109

Dynamic fluorescent imaging with indocyanine green for monitoring the therapeutic effects of photoimmunotherapy

Ali, Towhid, Nakajima, Takahito, Sano, Kohei, Sato, Kazuhide, Choyke, Peter L., Kobayashi, Hisataka

Journal:

Contrast Media & Molecular Imaging

Year:

2014

Language:

english

File:

PDF, 1.91 MB

english, 2014

110

Theoretical study of valence photoelectron spectra of Re(CO)[sub 5]X (X=Cl, Br, and I): A spin-orbit DK3 symmetry-adapted cluster/symmetry-adapted cluster-configuration interaction study

Nakajima, Takahito, Hane, Shintaro, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2006

Language:

english

File:

PDF, 519 KB

english, 2006

111

NTChem: A high-performance software package for quantum molecular simulation

Nakajima, Takahito, Katouda, Michio, Kamiya, Muneaki, Nakatsuka, Yutaka

Journal:

International Journal of Quantum Chemistry

Year:

2015

Language:

english

File:

PDF, 589 KB

english, 2015

112

[IEEE 2007 International Conference on Field-Programmable Technology - Kitakyusyu, Japan (2007.12.12-2007.12.14)] 2007 International Conference on Field-Programmable Technology - A Portable Co-Verification System Which Generates Testbench Automatically

Nakajima, Takahito, Namiki, Shigeru, Kinoshita, Shuhei, Shimizu, Naohiko

Year:

2007

Language:

english

File:

PDF, 254 KB

english, 2007

113

Theoretical investigation of enantioselectivity of cage-like supramolecular assembly: The insights into the shape complementarity and host-guest interaction

Ootani, Yusuke, Akinaga, Yoshinobu, Nakajima, Takahito

Journal:

Journal of Computational Chemistry

Year:

2015

Language:

english

File:

PDF, 639 KB

english, 2015

114

RECENT ADVANCES IN ELECTRONIC STRUCTURE THEORY

NAKAJIMA, TAKAHITO, TSUNEDA, TAKAO, NAKANO, HARUYUKI, HIRAO, KIMIHIKO

Journal:

Journal of Theoretical and Computational Chemistry

Year:

2002

Language:

english

File:

PDF, 1.54 MB

english, 2002

115

The relativistic complete active-space second-order perturbation theory with the four-component Dirac Hamiltonian

Abe, Minori, Nakajima, Takahito, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2006

Language:

english

File:

PDF, 441 KB

english, 2006

116

Linear-scaling multipole-accelerated Gaussian and finite-element Coulomb method

Watson, Mark A., Kurashige, Yuki, Nakajima, Takahito, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2008

Language:

english

File:

PDF, 634 KB

english, 2008

117

Relativistic diffusion Monte Carlo method: Zeroth-order regular approximation-diffusion Monte Carlo method in a spin-free formalism

Nakatsuka, Yutaka, Nakajima, Takahito

Journal:

The Journal of Chemical Physics

Year:

2012

Language:

english

File:

PDF, 595 KB

english, 2012

118

Role of F-18 FDG PET/CT in assessing IgG4-related disease with inflammation of head and neck glands

Tokue, Azusa, Higuchi, Tetsuya, Arisaka, Yukiko, Nakajima, Takahito, Tokue, Hiroyuki, Tsushima, Yoshito

Journal:

Annals of Nuclear Medicine

Year:

2015

Language:

english

File:

PDF, 727 KB

english, 2015

119

Theoretical study of exciton dissociation through hot states at donor–acceptor interface in organic photocell

Shimazaki, Tomomi, Nakajima, Takahito

Journal:

Physical Chemistry Chemical Physics

Year:

2015

Language:

english

File:

PDF, 1.87 MB

english, 2015

120

Activatable fluorescent cys-diabody conjugated with indocyanine green derivative: consideration of fluorescent catabolite kinetics on molecular imaging

Sano, Kohei, Nakajima, Takahito, Ali, Towhid, Bartlett, Derek W., Wu, Anna M., Kim, Insook, Paik, Chang H., Choyke, Peter L., Kobayashi, Hisataka

Journal:

Journal of Biomedical Optics

Year:

2013

Language:

english

File:

PDF, 4.06 MB

english, 2013

121

Selective cell elimination in vitro and in vivo from tissues and tumors using antibodies conjugated with a near infrared phthalocyanine

Sato, Kazuhide, Nakajima, Takahito, Choyke, Peter L., Kobayashi, Hisataka

Journal:

Year:

2015

Language:

english

File:

PDF, 1.45 MB

english, 2015

122

How Can We Understand Au 8 Cores and Entangled Ligands of Selenolate- and Thiolate-Protected Gold Nanoclusters Au 24 (ER) 20 and Au 20 (ER) 16 (E = Se, S; R = Ph, Me)? A Theoretical Study

Takagi, Nozomi, Ishimura, Kazuya, Matsui, Masafuyu, Fukuda, Ryoichi, Matsui, Toru, Nakajima, Takahito, Ehara, Masahiro, Sakaki, Shigeyoshi

Journal:

Journal of the American Chemical Society

Year:

2015

Language:

english

File:

PDF, 1.81 MB

english, 2015

123

Gaussian-based cutoff scheme on Hartree–Fock exchange term of dielectric-dependent potential

Shimazaki, Tomomi, Nakajima, Takahito

Journal:

Chemical Physics Letters

Year:

2015

Language:

english

File:

PDF, 446 KB

english, 2015

124

Two-component relativistic time-dependent density functional theory study on spin-forbidden transitions for metal polypyridyl complexes

Imamura, Yutaka, Kamiya, Muneaki, Nakajima, Takahito

Journal:

Chemical Physics Letters

Year:

2015

Language:

english

File:

PDF, 678 KB

english, 2015

125

Gaussian and finite-element Coulomb method for the fast evaluation of Coulomb integrals

Kurashige, Yuki, Nakajima, Takahito, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2007

Language:

english

File:

PDF, 184 KB

english, 2007

126

Efficient evaluation of the Coulomb force in the Gaussian and finite-element Coulomb method

Kurashige, Yuki, Nakajima, Takahito, Sato, Takeshi, Hirao, Kimihiko

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 446 KB

english, 2010

127

Theoretical study of a screened Hartree–Fock exchange potential using position-dependent atomic dielectric constants

Shimazaki, Tomomi, Nakajima, Takahito

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 1.15 MB

english, 2015

128

Full geometry optimizations of the CaMn4O4 model cluster for the oxygen evolving complex of photosystem II

Shoji, Mitsuo, Isobe, Hiroshi, Nakajima, Takahito, Yamaguchi, Kizashi

Journal:

Chemical Physics Letters

Year:

2015

Language:

english

File:

PDF, 824 KB

english, 2015

129

Preparation and long-term biodistribution studies of a PAMAM dendrimer G5–Gd-BnDOTA conjugate for lymphatic imaging

Opina, Ana Christina, Wong, Karen J, Griffiths, Gary L, Turkbey, Baris I, Bernardo, Marcelino, Nakajima, Takahito, Kobayashi, Hisataka, Choyke, Peter L, Vasalatiy, Olga

Journal:

Year:

2015

Language:

english

File:

PDF, 3.59 MB

english, 2015

130

Evaluation of bone scan index change over time on automated calculation in bone scintigraphy

Shintawati, Rini, Achmad, Arifudin, Higuchi, Tetsuya, Shimada, Hirotaka, Hirasawa, Hiromi, Arisaka, Yukiko, Takahashi, Ayako, Nakajima, Takahito, Tsushima, Yoshito

Journal:

Annals of Nuclear Medicine

Year:

2015

Language:

english

File:

PDF, 4.34 MB

english, 2015

131

Magnetite Ingested as a Nutritional Supplement: Unexpected Source of MRI Susceptibility Artifact

Taketomi-Takahashi, Ayako, Tsushima, Yoshito, Nakajima, Takahito, Takano, Akie, Amanuma, Makoto, Endo, Keigo

Journal:

American Journal of Roentgenology

Year:

2007

Language:

english

File:

PDF, 329 KB

english, 2007

132

Photoimmunotherapy of hepatocellular carcinoma-targeting Glypican-3 combined with nanosized albumin-bound paclitaxel

Hanaoka, Hirofumi, Nakajima, Takahito, Sato, Kazuhide, Watanabe, Rira, Phung, Yen, Gao, Wei, Harada, Toshiko, Kim, Insook, Paik, Chang H, Choyke, Peter L, Ho, Mitchell, Kobayashi, Hisataka

Journal:

Year:

2015

Language:

english

File:

PDF, 3.52 MB

english, 2015

133

From C 60 to Infinity: Large-Scale Quantum Chemistry Calculations of the Heats of Formation of Higher Fullerenes

Chan, Bun, Kawashima, Yukio, Katouda, Michio, Nakajima, Takahito, Hirao, Kimihiko

Journal:

Journal of the American Chemical Society

Year:

2016

Language:

english

File:

PDF, 1.47 MB

english, 2016

134

Theoretical Study on Spin-Forbidden Transitions of Osmium Complexes by Two-component Relativistic Time-dependent Density Functional Theory

Imamura, Yutaka, Kamiya, Muneaki, Nakajima, Takahito

Journal:

Chemical Physics Letters

Year:

2016

Language:

english

File:

PDF, 634 KB

english, 2016

135

Gaussian-based range-separation approach on Hartree–Fock exchange interaction and second-order perturbation theory

Shimazaki, Tomomi, Nakajima, Takahito

Journal:

Chemical Physics Letters

Year:

2016

Language:

english

File:

PDF, 726 KB

english, 2016

136

Real-time monitoring of hemodynamic changes in tumor vessels during photoimmunotherapy using optical coherence tomography

Liang, Chia-Pin, Nakajima, Takahito, Watanabe, Rira, Sato, Kazuhide, Choyke, Peter L., Chen, Yu, Kobayashi, Hisataka

Journal:

Journal of Biomedical Optics

Year:

2014

Language:

english

File:

PDF, 2.90 MB

english, 2014

137

Analyses on Thiophene-Based Donor–Acceptor Semiconducting Polymers toward Designing Optical and Conductive Properties: A Theoretical Perspective

Matsui, Toru, Imamura, Yutaka, Osaka, Itaru, Takimiya, Kazuo, Nakajima, Takahito

Journal:

The Journal of Physical Chemistry C

Year:

2016

Language:

english

File:

PDF, 2.13 MB

english, 2016

138

Differentiation of sarcoidosis-lymphoma syndrome lesions: a case report on the use of two different positron emission tomography tracers

Yudistiro, Ryan, Arisaka, Yukiko, Tokue, Azusa, Nakajima, Takahito

Journal:

BMC Medical Imaging

Year:

2016

Language:

english

File:

PDF, 1.72 MB

english, 2016

139

Prostaglandin E (EP) receptor subtypes and sleep

Yoshida, Yasushi, Matsumura, Hitoshi, Nakajima, Tomoko, Mandai, Masaharu, Urakami, Takahito, Kuroda, Kenji, Yoneda, Hiroshi

Journal:

Year:

2000

Language:

english

File:

PDF, 176 KB

english, 2000

140

Shock-induced right ventricular pacing failure caused by a short circuit: Uncommon but life-threatening complication of the Riata lead

Morishima, Itsuro, Nakajima, Hiroshi, Tsuboi, Hideyuki, Yokoyama, Yumiko, Naito, Kazuhiro, Sone, Takahito

Journal:

HeartRhythm Case Reports

Year:

2015

Language:

english

File:

PDF, 1.17 MB

english, 2015

141

A case of intra-articular ganglion cysts of the knee joint: correlation between arthroscopic and magnetic resonance imaging

Kodaira, Sayaka, Nakajima, Takahito, Takahashi, Ryosuke, Moriya, Shingo, Nakagawa, Tomoyuki, Ohtake, Hidenori, Tsushima, Yoshito

Journal:

BMC Medical Imaging

Year:

2016

Language:

english

File:

PDF, 973 KB

english, 2016

142

Novel HPS6 mutations identified by whole-exome sequencing in two Japanese sisters with suspected ocular albinism

Miyamichi, Daisuke, Asahina, Miki, Nakajima, Junya, Sato, Miho, Hosono, Katsuhiro, Nomura, Takahito, Negishi, Takashi, Miyake, Noriko, Hotta, Yoshihiro, Ogata, Tsutomu, Matsumoto, Naomichi

Journal:

Journal of Human Genetics

Year:

2016

Language:

english

File:

PDF, 792 KB

english, 2016

143

A Basic Germanodecatungstate with a −7 Charge: Efficient Chemoselective Acylation of Primary Alcohols

Sugahara, Kosei, Satake, Naoto, Kamata, Keigo, Nakajima, Takahito, Mizuno, Noritaka

Journal:

Angewandte Chemie

Year:

2014

Language:

english

File:

PDF, 489 KB

english, 2014

144

ChemInform Abstract: A Basic Germanodecatungstate with a -7 Charge: Efficient Chemoselective Acylation of Primary Alcohols.

Sugahara, Kosei, Satake, Naoto, Kamata, Keigo, Nakajima, Takahito, Mizuno, Noritaka

Journal:

Year:

2015

File:

PDF, 28 KB

2015

145

A parallel implementation of 2-D/3-D image registration for computer-assisted surgery

Ino, Fumihiko, Kawasaki, Yasuhiro, Tashiro, Takahito, Nakajima, Yoshikazu, Sato, Yoshinobu, Tamura, Shinichi, Hagihara, Kenichi

Journal:

International Journal of Bioinformatics Research and Applications

Year:

2006

Language:

english

File:

PDF, 565 KB

english, 2006

146

Clinicopathological Characteristics, Surgery and Survival Outcomes of Patients with Duodenal Gastrointestinal Stromal Tumors

Sugase, Takahito, Takahashi, Tsuyoshi, Nakajima, Kiyokazu, Hirota, Seiichi, Masuzawa, Toru, Nishida, Toshirou, Kimura, Yutaka, Miyazaki, Yasuhiro, Makino, Tomoki, Kurokawa, Yukinori, Yamasaki, Makoto,

Journal:

Year:

2016

Language:

english

File:

PDF, 153 KB

english, 2016

147

Distribution and clearance of retained gadolinium in the brain: differences between linear and macrocyclic gadolinium based contrast agents in a mouse model

Kartamihardja, A. Adhipatria P., Nakajima, Takahito, Kameo, Satomi, Koyama, Hiroshi, Tsushima, Yoshito

Journal:

British Journal of Radiology

Year:

2016

Language:

english

File:

PDF, 961 KB

english, 2016

148

Spectroscopic and Computational Study of Acetic Acid and Its Cyclic Dimer in the Near-Infrared Region

Beć, Krzysztof B., Futami, Yoshisuke, Wójcik, Marek J., Nakajima, Takahito, Ozaki, Yukihiro

Journal:

Journal of Physical Chemistry A

Year:

2016

Language:

english

File:

PDF, 2.52 MB

english, 2016

149

Relativistic Effects for Polarizabilities and Hyperpolarizabilities of Rare Gas Atoms

Nakajima, Takahito, Hirao, Kimihiko

Journal:

Chemistry Letters

Year:

2001

Language:

english

File:

PDF, 39 KB

english, 2001

150

Application of the dielectric-dependent screened exchange potential approach to organic photocell materials

Shimazaki, Tomomi, Nakajima, Takahito

Journal:

Physical Chemistry Chemical Physics

Year:

2016

Language:

english

File:

PDF, 1.85 MB

english, 2016

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