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density functional theory (võtmesõna)
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1
artikkel ajakirjas
Calculated tautomeric equilibria and X-ray structures of 2-substituted N-methoxy-9-methyl-9H-purin-6-amines
Gundersen, Lise-Lotte
;
Görbitz, Carl Henrik
;
Neier, Liina
;
Roggen, Heidi
;
Tamm, Toomas
Theoretical chemistry accounts
2011
/
p. 349-359
artikkel ajakirjas
2
artikkel ajakirjas
Investigation of the solar cell materials Cu(In,Ga)Se2 and Cu2ZnSnS4 with muon spin spectroscopy and density-functional calculations
Vilao, Rui C.
;
Marinopoulos, Apostolos G.
;
dos Santos, Diego Garcia
;
Alberto, Helena Vieira
;
Gil, Joao Campos
;
Mengyan, Patrick W.
;
Kauk-Kuusik, Marit
;
Lord, James
;
Weidinger, Alois
Journal of applied physics
2024
/
art. 055704
https://doi.org/10.1063/5.0205837
artikkel ajakirjas
3
artikkel ajakirjas
Isomers and conformers of complexes of Ti(OiPr)4 with cuclopentane-1,2-dione : NMR study and DFT calculations
Osadchuk, Irina
;
Pehk, Tõnis
;
Paju, Anne
;
Lopp, Margus
;
Öeren, Mario
;
Tamm, Toomas
International journal of quantum chemistry
2014
/
p. 1012-1018 : ill
artikkel ajakirjas
Kirjeid leitud 3, kuvan
1 - 3
võtmesõna
238
1.
density functional theory
2.
time-dependent density functional theory (TD-DFT)
3.
density functional calculations
4.
bimodal high-density polyethylene (HDPE) PE100
5.
complex density
6.
composite winding density control
7.
current density
8.
density
9.
density currents
10.
density dependence
11.
density distributions
12.
density forecasts
13.
density of representation
14.
Density-driven overfows
15.
direct density ratio estimation
16.
directional power spectral density
17.
dislocation density
18.
doping density
19.
field density in tissue
20.
high-density apolipoprotein A
21.
hyper-branched linear low density PE
22.
linear heat density
23.
Linear low-density polyethylene
24.
liquid density
25.
low density areas
26.
low density polyethylene (LDPE)
27.
low-density lipoprotein
28.
low-density lipoprotein cholesterol
29.
low-density polyethylene
30.
low-density-polyethylene
31.
magnetic flux density
32.
material density
33.
medium density fibreboard (MDF) cracking
34.
oxidized low-density lipoproteins
35.
power spectral density
36.
probability density function
37.
projected device density of states (PDDOS)
38.
relative density
39.
wave density spectra
40.
vertical channel density (VD)
41.
vertical link density
42.
extra-functional verification
43.
FIM (functional independence measure)
44.
FIM + FAM (functional assessment measure)
45.
functional diversity
46.
functional approximation
47.
functional biomaterials
48.
functional BIST
49.
functional capacity of cooperation
50.
functional capacity of integration
51.
functional complexes
52.
functional components
53.
functional connectivity
54.
functional data analysis
55.
functional derating
56.
functional de-rating
57.
functional diversity
58.
functional equivalence principle
59.
Functional Failure Rate (FFR)
60.
functional fault model
61.
functional food
62.
functional gene analysis
63.
functional groups
64.
functional institutional analysis
65.
functional ionic liquids
66.
functional iteration
67.
functional material
68.
functional materials
69.
functional models
70.
functional morphology
71.
functional polymer
72.
functional power plants
73.
functional power-plants
74.
functional prediction
75.
functional properties
76.
functional reactive programming
77.
functional requirements
78.
functional safety
79.
functional self-test
80.
functional smoothie
81.
Functional specialist in AI for public services
82.
functional state of the muscles -tiredness
83.
functional stress programs
84.
functional test generation
85.
functional verification
86.
functional-safety
87.
high-level functional fault model
88.
hybrid functional
89.
non-robust and functional sensitization
90.
non-robust and functional sensitization of delay faults
91.
size of functional groups
92.
a coherent theory of proofs
93.
activity theory
94.
adaptive structuration theory (AST)
95.
algebraic number theory
96.
algebraic theory
97.
algorithm design and theory
98.
beam theory
99.
bicategory theory
100.
catastrophe theory
101.
category theory
102.
chaos theory
103.
coding theory
104.
cognitive theory
105.
commitment theory
106.
communication channels (information theory)
107.
complexity leadership theory
108.
complexity theory
109.
computation theory
110.
computer softwaregraph theory
111.
conservation of resources theory
112.
Consumer Culture Theory
113.
control theory
114.
Cooper-Helmstetter cell cycle theory
115.
cosmology: theory
116.
critical theory of technology
117.
cultural theory of international relations
118.
dark matter theory
119.
decision theory
120.
Dempster-Shafer theory
121.
Demster-Shafer Theory
122.
dependent type theory
123.
design theory
124.
development theory
125.
Digital Government Theory: Development and Application
126.
dispersive theory
127.
domain theory
128.
ecological systems theory
129.
economic theory
130.
end of theory
131.
energetic impact theory
132.
evolutionary theory of policy capacity
133.
Flow theory
134.
formal language theory
135.
fully nonlinear potential theory
136.
game theory
137.
general systems theory
138.
general theory of information transfer
139.
general vibration theory
140.
graph theory
141.
gravitational waves / theory
142.
grounded theory
143.
group theory
144.
group threat theory
145.
higher-order beam theory
146.
History and Theory
147.
homotopy theory
148.
homotopy type theory
149.
housemoney effect prospect theory
150.
iceberg theory of culture
151.
image theory
152.
information theory
153.
innovation theory
154.
institutional theory
155.
intellectual capital theory
156.
interdependence theory
157.
inverse problem theory/applications
158.
inverse problems theory/applications
159.
job search theory
160.
Lawvere theory
161.
layer-wise displacement theory
162.
linear systems theory
163.
maritime investment theory
164.
mechanism design theory
165.
middle-range theory
166.
modern portfolio theory
167.
network theory
168.
nonlinear shallow water theory
169.
nonlinear shallow-water theory
170.
nonlinear strip theory
171.
nonlinear theory
172.
normal torsion theory
173.
number theory
174.
organization theory
175.
organizational theory
176.
peer‐to‐peer theory
177.
perceived customer value theory
178.
phase field theory
179.
picture theory
180.
protection motivation theory
181.
proto-theory of design
182.
punctuated equilibrium theory
183.
rational choice theory
184.
real options theory
185.
realization theory
186.
reduction theory
187.
refined zigzag theory
188.
regulatory focus theory
189.
sampling theory
190.
scapegoat theory
191.
search and matching theory
192.
self-determination theory
193.
self-determination theory of work motivation
194.
set theory
195.
shallow water theory
196.
shallow‐water theory
197.
sign theory
198.
signalling theory
199.
social identity theory
200.
social practice theory
201.
social presence theory
202.
social representation theory
203.
social system theory
204.
social systems theory
205.
sociological curriculum theory
206.
speech-act theory
207.
stakeholder theory
208.
Stakeholder-oriented decision theory
209.
State Theory
210.
stimulus-organism-response theory
211.
stochastic learning theory
212.
strategic narrative theory
213.
strategic narrative theory
214.
Straussian theory model
215.
structuration theory
216.
switching theory
217.
synchronous reference frame theory
218.
system theory
219.
systems theory
220.
the RAT theory
221.
theory
222.
theory and practice of meta-modelling with application in healthcare
223.
theory of accounting
224.
Theory Of Constraints (TOC)
225.
theory of economic development
226.
theory of inventive problem solving (TRIZ)
227.
theory of natural disaster
228.
Theory of paradox
229.
theory of planned behavior
230.
theory of planned behaviour
231.
theory of signs
232.
theory of value
233.
ticked cubical type theory
234.
type theory
235.
unified theory of acceptance and use of technology
236.
value theory
237.
virtual disc theory
238.
2D+T theory
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