Henry F. Schaefer: search on Z-Library

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1

Green Finance and the German Banking System

Schaefer, Henry

Journal:

SSRN Electronic Journal

Year:

2017

Language:

english

File:

PDF, 1.31 MB

english, 2017

2

A Conceptual Model of the Role of Complexity in the Care of Patients With Multiple Chronic Conditions

Grembowski, David, Schaefer, Judith, Johnson, Karin E., Fischer, Henry, Moore, Susan L., Tai-Seale, Ming, Ricciardi, Richard, Fraser, James R., Miller, Donald, LeRoy, Lisa

Journal:

Year:

2014

Language:

english

File:

PDF, 267 KB

english, 2014

3

Concerning the precision of standard density functional programs: Gaussian, Molpro, NWChem, Q-Chem, and Gamess

Brian N. Papas, Henry F. Schaefer III

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2006

Language:

english

File:

PDF, 328 KB

english, 2006

4

The demand of sustainable property investments in Germany

Schaefer, Henry, Gromer, Christian, Neligan, Adriana

Journal:

Journal of Property Investment & Finance

Year:

2012

Language:

english

File:

PDF, 220 KB

english, 2012

5

Testing the Lake Agassiz meltwater trigger for the Younger Dryas

Lowell, Thomas, Waterson, Nicholas, Fisher, Timothy, Loope, Henry, Glover, Katherine, Comer, Gary, Hajdas, Irka, Denton, George, Schaefer, Joerg, Rinterknecht, Vincent, Broecker, Wallace, Teller, Jame

Journal:

Eos Transactions American Geophysical Union

Year:

2005

Language:

english

File:

PDF, 8.51 MB

english, 2005

6

Orbital-optimized density cumulant functional theory

Sokolov, Alexander Yu., Schaefer, Henry F.

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 425 KB

english, 2013

7

Interactions of Electrons with Bare and Hydrated Biomolecules: From Nucleic Acid Bases to DNA Segments

Gu, Jiande, Leszczynski, Jerzy, Schaefer, Henry F.

Journal:

Chemical Reviews

Year:

2012

Language:

english

File:

PDF, 20.22 MB

english, 2012

8

Introduction to proceedings of Molecular Quantum Mechanics 2013: electron correlation: the many-body problem at the heart of chemistry

Head-Gordon, Martin, Lüthi, Hans Peter, Gauss, Jürgen, Schaefer, Henry F., Stanton, John F.

Journal:

Molecular Physics

Year:

2014

Language:

english

File:

PDF, 40 KB

english, 2014

9

Germylenes: Structures, Electron Affinities, and Singlet−Triplet Gaps of the Conventional XGeCY 3 (X = H, F, Cl, Br, and I; Y = F and Cl) Species and the Unexpected Cyclic XGeCY 3 (Y = Br and I) Systems

Bundhun, Ashwini, Abdallah, Hassan H., Ramasami, Ponnadurai, Schaefer, Henry F.

Journal:

Journal of Physical Chemistry A

Year:

2010

Language:

english

File:

PDF, 7.85 MB

english, 2010

10

Interfacing Q-Chem and CHARMM to perform QM/MM reaction path calculations

H. Lee Woodcock III, Milan Hodošček, Andrew T. B. Gilbert, Peter M. W. Gill, Henry F. Schaefer III, Bernard R. Brooks

Journal:

Journal of Computational Chemistry

Year:

2007

Language:

english

File:

PDF, 487 KB

english, 2007

11

SPIE Proceedings [SPIE SPIE Defense, Security, and Sensing - Baltimore, Maryland, USA (Monday 29 April 2013)] Airborne Intelligence, Surveillance, Reconnaissance (ISR) Systems and Applications X - Advanced metal mirror processing for tactical ISR systems

Schaefer, John P., Henry, Daniel J., Lange, Davis A., Linne von Berg, Dale, Rajan, S. Danny, Walls, Thomas J., Young, Darrell L.

Year:

2013

Language:

english

File:

PDF, 1.15 MB

english, 2013

12

Atomic and Molecular Electron Affinities: Photoelectron Experiments and Theoretical Computations

Rienstra-Kiracofe, Jonathan C., Tschumper, Gregory S., Schaefer, Henry F., Nandi, Sreela, Ellison, G. Barney

Journal:

Chemical Reviews

Year:

2002

Language:

english

File:

PDF, 471 KB

english, 2002

13

Quantification of Hydrogen Bond Strength Based on Interaction Coordinates: A New Approach

Pandey, Sarvesh Kumar Kumar, Manogaran, Dhivya, Manogaran, Sadasivam, Schaefer, Henry F.

Journal:

Journal of Physical Chemistry A

Year:

2017

Language:

english

File:

PDF, 1.52 MB

english, 2017

14

Psychometric properties of the Sociocultural Attitudes Towards Appearance Questionnaire-4 (SATAQ-4) in French women and men

Rodgers, Rachel F., Schaefer, Lauren M., Thompson, J. Kevin, Girard, Marilou, Bertrand, Mélanie, Chabrol, Henri

Journal:

Year:

2016

Language:

english

File:

PDF, 509 KB

english, 2016

15

Janus: An Extensible Open-Source Software Package for Adaptive QM/MM Methods

Zhang, Boyi, Altarawy, Doaa, Barnes, Taylor, Turney, Justin M., Schaefer, Henry F.

Journal:

Journal of Chemical Theory and Computation

Year:

2019

Language:

english

File:

PDF, 3.58 MB

english, 2019

16

Metal–Metal (MM) Bond Distances and Bond Orders in Binuclear Metal Complexes of the First Row Transition Metals Titanium Through Zinc

Duncan Lyngdoh, Richard H., Schaefer, Henry F., King, R. Bruce

Journal:

Chemical Reviews

Year:

2018

Language:

english

File:

PDF, 4.22 MB

english, 2018

17

Identification of three novel mutations in human EYA1 protein associated with branchio-oto-renal syndrome

Shrawan Kumar, William J. Kimberling, Michael D. Weston, Bradley G. Schaefer, Mary Anne Berg, Henri A. M. Marres, Cor W. R. J. Cremers

Journal:

Year:

1998

Language:

english

File:

PDF, 301 KB

english, 1998

18

Construction and use of atomicL-S eigenfunctions

Henry F. Schaefer III, Frank E. Harris

Journal:

Journal of Computational Physics

Year:

1968

Language:

english

File:

PDF, 474 KB

english, 1968

19

The Structure and Cl-O Dissociation Energy of the ClOO Radical: Finally, The Right Answers for The Right Reason

Abbott, Adam S., Schaefer, Henry F.

Journal:

Journal of Physical Chemistry A

Year:

2018

Language:

english

File:

PDF, 2.35 MB

english, 2018

20

Student-Friendly Guide to Molecular Integrals

Murphy, Kevin V., Turney, Justin M., Schaefer, Henry F.

Journal:

Journal of Chemical Education

Year:

2018

Language:

english

File:

PDF, 1.85 MB

english, 2018

21

ChemInform Abstract: NF5 — Viable or Not?

Holger F. Bettinger, Paul von Rague Schleyer, Henry F. III Schaefer

Journal:

Year:

1999

File:

PDF, 31 KB

1999

22

Theoretical characterization of the transition structure for an SN2 reaction at neutral nitrogen

Buhl, Michael, Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1993

Language:

english

File:

PDF, 786 KB

english, 1993

23

Metal−Metal Quintuple and Sextuple Bonding in Bent Dimetallocenes of the Third Row Transition Metals

Xu, Bing, Li, Qian-Shu, Xie, Yaoming, King, R. Bruce, Schaefer, Henry F.

Journal:

Journal of Chemical Theory and Computation

Year:

2010

Language:

english

File:

PDF, 3.83 MB

english, 2010

24

The Quest for Metal–Metal Quadruple and Quintuple Bonds in Metal Carbonyl Derivatives: Nb 2 (CO) 9 and Nb 2 (CO) 8

Tang, Lihong, Luo, Qiong, Li, Qian-shu, Xie, Yaoming, King, R. Bruce, Schaefer, Henry F.

Journal:

Journal of Chemical Theory and Computation

Year:

2012

Language:

english

File:

PDF, 4.63 MB

english, 2012

25

Aluminum−Phosphorus Compounds with Low Coordination Numbers: Structures, Energies, and Vibrational Frequencies of the AlPH 2 , AlPH 3 , and AlPH 4 Isomers and the H 3 Al−PH 3 Adduct

Davy, Randall D., Schaefer, Henry F.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 515 KB

english, 1997

26

Chlorine peroxide (Cl 2 O 2 ) and its isomers: structures, spectroscopy, formation and thermochemistry

Horný, Ľuboš, Quack, Martin, Schaefer, Henry F., Willeke, Martin

Journal:

Molecular Physics

Year:

2016

Language:

english

File:

PDF, 902 KB

english, 2016

27

Can Density Cumulant Functional Theory Describe Static Correlation Effects?

Mullinax, J. Wayne, Sokolov, Alexander Yu., Schaefer, Henry F.

Journal:

Journal of Chemical Theory and Computation

Year:

2015

Language:

english

File:

PDF, 1.09 MB

english, 2015

28

Performance of CRONUS-P – A pyroxene reference material for helium isotope analysis

Schaefer, Joerg M., Winckler, Gisela, Blard, Pierre-Henri, Balco, Greg, Shuster, David L., Friedrich, Ronny, Jull, A.J.T., Wieler, Rainer, Schluechter, Christian

Journal:

Quaternary Geochronology

Year:

2016

Language:

english

File:

PDF, 475 KB

english, 2016

29

The Nature of the Gallium−Gallium Triple Bond

Xie, Yaoming, Grev, R. S., Gu, Jiande, Schaefer, Henry F., Schleyer, Paul v. R., Su, Jianrui, Li, Xiao-Wang, Robinson, Gregory H.

Journal:

Journal of the American Chemical Society

Year:

1998

Language:

english

File:

PDF, 160 KB

english, 1998

30

Effects of electron correlation on the geometrical structure of cyanomethylene

Zandler, Melvin E., Goddard, John D., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1979

Language:

english

File:

PDF, 604 KB

english, 1979

31

Molecular orbital interpretation of the metal–metal multiple bonding in coaxial dibenzene dimetal compounds of iron, manganese, and chromium

Wang, Hui, Die, Dong, Wang, Hongyan, Xie, Yaoming, King, R. Bruce, Schaefer, Henry F.

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2014

Language:

english

File:

PDF, 2.45 MB

english, 2014

32

Benchmark Study of Density Cumulant Functional Theory: Thermochemistry and Kinetics

Copan, Andreas V., Sokolov, Alexander Yu., Schaefer, Henry F.

Journal:

Journal of Chemical Theory and Computation

Year:

2014

Language:

english

File:

PDF, 923 KB

english, 2014

33

Popular Theoretical Methods Predict Benzene and Arenes To Be Nonplanar

Moran, Damian, Simmonett, Andrew C., Leach, Franklin E., Allen, Wesley D., Schleyer, Paul v. R., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

2006

Language:

english

File:

PDF, 35 KB

english, 2006

34

Is coupled cluster singles and doubles (CCSD) more computationally intensive than quadratic configuration interaction (QCISD)?

Scuseria, Gustavo E., Schaefer, Henry F.

Journal:

The Journal of Chemical Physics

Year:

1989

Language:

english

File:

PDF, 539 KB

english, 1989

35

The Wolff Rearrangement: The Relevant Portion of the Oxirene-Ketene Potential Energy Hypersurface

Scott, Anthony P., Nobes, Ross H., Schaefer, Henry F., Radom, Leo

Journal:

Journal of the American Chemical Society

Year:

1994

Language:

english

File:

PDF, 1.16 MB

english, 1994

36

Three isomers of the aluminum-acetylene system

Trenary, Michael, Casida, Mark E., Brooks, Bernard R., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1979

Language:

english

File:

PDF, 303 KB

english, 1979

37

The Li···HF van der Waals minimum and the barrier to the deep HF–Li potential well

Fan, Qunchao, Feng, Hao, Sun, Weiguo, Xie, Yaoming, Wu, Chia-Hua, Allen, Wesley D., Schaefer, Henry F.

Journal:

Molecular Physics

Year:

2014

Language:

english

File:

PDF, 317 KB

english, 2014

38

Binuclear pentalene manganese carbonyl complexes: conventional trans and unconventional cis structures

Li, Huidong, Feng, Hao, Sun, Weiguo, Fan, Qunchao, Xie, Yaoming, King, R. Bruce, Schaefer, Henry F.

Journal:

Molecular Physics

Year:

2012

Language:

english

File:

PDF, 1.37 MB

english, 2012

39

The wealth of energetically low-lying isomers for very simple organometallic systems. The aluminum-acetylene (AlC2H2) system

Xie, Yaoming, Yates, Brian F., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1990

Language:

english

File:

PDF, 896 KB

english, 1990

40

Localization of Borrelia Burgdorferi in the Nervous System and Other Organs in a Nonhuman Primate Model of Lyme Disease

Cadavid, Diego, O'Neill, Tim, Schaefer, Henry, Pachner, Andrew R

Journal:

Laboratory Investigation

Year:

2000

Language:

english

File:

PDF, 1.05 MB

english, 2000

41

Electrophile Affinity: A Reactivity Measure for Aromatic Substitution

Koleva, Gergana, Galabov, Boris, Wu, Judy I., Schaefer III, Henry F., Schleyer, Paul von R.

Journal:

Journal of the American Chemical Society

Year:

2009

Language:

english

File:

PDF, 795 KB

english, 2009

42

Analytic Raman intensities from molecular electronic wave functions

Frisch, Michael J., Yamaguchi, Yukio, Gaw, Jeffrey F., Schaefer, Henry F., Binkley, J. Stephen

Journal:

The Journal of Chemical Physics

Year:

1986

Language:

english

File:

PDF, 425 KB

english, 1986

43

Restructuring versus Reform

Henry W. Schaefer

Journal:

Year:

1973

Language:

english

File:

PDF, 140 KB

english, 1973

44

Accelerating the convergence of the coupled-cluster approach: The use of the DIIS method

Gustavo E. Scuseria, Timothy J. Lee, Henry F. Schaefer III

Journal:

Chemical Physics Letters

Year:

1986

Language:

english

File:

PDF, 370 KB

english, 1986

45

Electrophile Affinity: Quantifying Reactivity for the Bromination of Arenes

Galabov, Boris, Koleva, Gergana, Schaefer, Henry F., Schleyer, Paul v. R.

Journal:

Journal of Organic Chemistry

Year:

2010

Language:

english

File:

PDF, 987 KB

english, 2010

46

A Note on Over-Full Employment Planning, Priorities and Prices

Journal:

Year:

1971

Language:

english

File:

PDF, 126 KB

english, 1971

47

The Road to 13−15 Nano Structures: Structures and Energetics of (MYH 2 ) 4 Tetramers (M = B, Al, Ga; Y = N, P, As)

Timoshkin, Alexey Y., Schaefer, Henry F.

Journal:

Journal of Physical Chemistry A

Year:

2010

Language:

english

File:

PDF, 3.93 MB

english, 2010

48

Is silver a mere terminal oxidant in palladium catalyzed C–H bond activation reactions?

Bhaskararao, Bangaru, Singh, Sukriti, Anand, Megha, Verma, Pritha, Prakash, Prafull, C, Athira, Malakar, Santanu, Schaefer, Henry F., Sunoj, Raghavan B.

Journal:

Chemical Science

Year:

2020

File:

PDF, 1.59 MB

2020

49

Approaching the Hartree-Fock limit for organotransition metal complexes

Henry F. Schaefer III

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1981

Language:

english

File:

PDF, 1.26 MB

english, 1981

50

Striking similarities between elementary silicon and aluminum compounds: monobridged, dibridged, trans-bent, and vinylidene isomers of aluminum hydride (Al2H2)

Palagyi, Zoltan, Grev, Roger S, Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1993

Language:

english

File:

PDF, 951 KB

english, 1993

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