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T

T. Daniel Crawford

Virginia Tech

46H指数
258论文数
1.1W被引数
收录论文 92
发表时间
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The Vibrational Raman Optical Activity of β-Propiolactone Derivatives Computed with Coupled-Cluster Theoryβ-丙炔酸内酯衍生物的振动拉曼光学活性基于耦合簇理论计算
errJournal of Physical Chemistry A
IF2.8
err2026-09-17
err0
PREAI
errMya S. Pederson; Luther D. Crum; Ethan J. Poncelet; Brendan M. Shumberger; T. Daniel Crawford; Rollin A. King
err分享
err收藏
Chemical Interpretation of Time-Dependent Coupled-Cluster Theory时间相关耦合簇理论的化学诠释
errJournal of Physical Chemistry A
IF2.8
err2026-08-13
err0
PREAI
errAparna Krishnan; Håkon Emil Kristiansen; Benjamin G. Peyton; T. Daniel Crawford; Thomas Bondo Pedersen
err分享
err收藏
Quantum Chemistry Software for Molecules and Materials量子化学软件（用于分子与材料）
errThe Journal of Physical Chemistry A
IF2.8
err2026-04-09
err0
PREAI
errT. Daniel Crawford; Andreas Dreuw
err分享
err收藏
Unlocking the future of materials science: key insights from the DCTMD workshop解锁材料科学的未来：DCTMD 工作坊的关键见解
errJOURNAL OF MATERIALS INFORMATICS
IF5.6
err2025-12-01
err0
PREAI
errKobayashi, Rika; Amos, Roger D.; Crawford, T. Daniel; Hao, Hongxia; Liu, Yi; Lookman, Turab; Ramprasad, Rampi; Scheffler, Matthias; Wang, Hong; Zhang, Tong-Yi
err分享
err收藏
Tunneling through 100 Years of Quantum Mechanics: An ACS Collection to Celebrate the Centennial穿越100年量子力学：ACS系列文集庆祝百年纪念
errACS Applied Materials and Interfaces
IF8.2
err2025-11-01
err0
PREAI
errCrawford, Daniel; Muller-Buschbaum, Peter; Quidant, Romain
err分享
err收藏
SEAMM: A Simulation Environment for Atomistic and Molecular ModelingSEAMM：用于原子和分子建模的仿真环境
errThe Journal of Physical Chemistry A
IF0
err2025-07-18
err0
errOAAI
errPaul Saxe; Jessica Nash; Mohammad Mostafanejad; Eliseo Marin-Rimoldi; Hasnain Hafiz; Louis G. Hector Jr; T. Daniel Crawford
err分享
err收藏
50 and 100 Years Ago in The Journal of Physical Chemistry-2025 Edition50和100年前在《物理化学杂志》-2025年版
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2025-05-08
err0
PREAI
errShea, Joan-Emma; Crawford, T. Daniel; Kirchner, Barbara; Pint, Cary
err分享
err收藏
50 and 100 Years Ago in The Journal of Physical Chemistry-2025 Edition《物理化学杂志》2025版：50年前与100年前
errJOURNAL OF PHYSICAL CHEMISTRY B
IF2.9
err2025-05-08
err0
PREAI
errShea, Joan-Emma; Crawford, T. Daniel; Pint, Cary
err分享
err收藏
50 and 100 Years Ago in The Journal of Physical Chemistry-2025 Edition50和100年前在《物理化学杂志》-2025版
errJOURNAL OF PHYSICAL CHEMISTRY A
IF2.8
err2025-05-08
err0
PREAI
errShea, Joan-Emma; Crawford, T. Daniel; Pint, Cary; Hartland, Gregory V.
err分享
err收藏
Analytic Computation of Vibrational Circular Dichroism Spectra Using Second-Order Møller-Plesset Perturbation Theory使用二阶Møller-Plesset微扰理论解析计算振动圆二色谱
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-03-25
err0
errOAAI
errShumberger, Brendan M.; Pearce, Kirk C.; Crawford, T. Daniel
err分享
err收藏
A Review of 2024 at The Journal of Physical Chemistry《物理化学杂志》2024年回顾
errJOURNAL OF PHYSICAL CHEMISTRY A
IF2.8
err2025-01-09
err0
PREAI
errShea, Joan-Emma; Crawford, T. Daniel; Hartland, Gregory V.; Pint, Cary L.
err分享
err收藏
A Review of 2024 at The Journal of Physical Chemistry
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2025-01-09
err0
PREAI
errShea, Joan-Emma; Crawford, T. Daniel; Kirchner, Barbara; Hartland, Gregory V.; Pint, Cary L.
err分享
err收藏
A Review of 2024 at The Journal of Physical Chemistry《物理化学期刊》对2024年的回顾
errJOURNAL OF PHYSICAL CHEMISTRY B
IF2.9
err2025-01-09
err0
PREAI
errShea, Joan-Emma; Crawford, T. Daniel; Hartland, Gregory V.; Pint, Cary L.
err分享
err收藏
Simulation of Vibrational Circular Dichroism Spectra Using Second-Order Møller-Plesset Perturbation Theory and Configuration Interaction Doubles
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-08-13
err0
errOAAI
errShumberger, Brendan M.; Crawford, T. Daniel
err分享
err收藏
50 and 100 Years Ago in The Journal of Physical Chemistry-2024 Edition
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2024-03-07
err0
errOAAI
errShea, Joan-Emma; Crawford, T. Daniel; Kirchner, Barbara; Hartland, Gregory V.; Aumiller, William
err分享
err收藏
2023: A Year in Review
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2024-01-11
err0
PREAI
errShea, Joan-Emma; Crawford, T. Daniel; Kirchner, Barbara; Hartland, Gregory V.; Aumiller, William
err分享
err收藏
Quantum Simulation of Molecular Response Properties in the NISQ Era
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-12-06
err17
PREAI
errKumar, Ashutosh; Asthana, Ayush; Abraham, Vibin; Crawford, T. Daniel; Mayhall, Nicholas J.; Zhang, Yu; Cincio, Lukasz; Tretiak, Sergei; Dub, Pavel A.
err分享
err收藏
Early-Career and Emerging Researchers in Physical Chemistry Volume 2早期职业和新兴的研究人员在物理化学第2卷
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2023-11-02
err0
errOAAI
errAlexandrova, Anastassia N.; Biteen, Julie S.; Coriani, Sonia; Geiger, Franz M.; Gewirth, Andrew A.; Goward, Gillian R.; Guo, Hua; Huang, Libai; Li, Jian-Feng; Liedl, Tim; Link, Stephan; Liu, Zhi-Pan; Maiti, Sudipta; Orr-Ewing, Andrew J.; Osborn, David L.; Pfaendtner, Jim; Roux, Benoit; Schmid, Friederike; Schmidt, J. R.; Schneider, William F.; Slipchenko, Lyudmila V.; Solomon, Gemma C.; van Bokhoven, Jeroen A.; Van Speybroeck, Veronique; Ye, Shen; Crawford, T. Daniel; Zanni, Martin T.; Hartland, Gregory V.; Shea, Joan-Emma
err分享
err收藏
50 and 100 Years Ago in The Journal of Physical Chemistry 2023
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2023-03-16
err0
errOAAI
errShea, Joan-Emma; Crawford, T. Daniel; Zanni, Martin T.; Hartland, Gregory V.; Aumiller, William
err分享
err收藏
A Review of 2022 and a Look at 2023
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2023-01-12
err0
errOAAI
errShea, Joan-Emma; Crawford, T. Daniel; Zanni, Martin T.; Hartland, Gregory V.; Aumiller, William
err分享
err收藏

研究方向

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合作学者
合作期刊
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George C. Schatz
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B
Benoı̂t Roux
H 指数: 128 · 论文数: 722
J
Juan Bisquert
H 指数: 124 · 论文数: 658
V
Vijay S. Pande
H 指数: 110 · 论文数: 494
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